SMILE	names	id
CO[C@H]1C[C@H](OC)[C@H](O)[C@@H](C)O1	Methyl [beta]-D-cymaropyranoside	462
C=C(C)C(Br)CC(Br)/C(C)=C/C=O	(-)-4,6-Dibromo-3,7-dimethyl-2E,7-octadienal	202
COc3c(O)cc2oc1c(OC)c(O)cc(O)c1c(=O)c2c3O	1,3,6,8-tetrahydroxy-2,5-dimethoxyxanthone	337
Brc2ccc1c(Br)c[nH]c1c2	3,6-Dibromoindole	302
Cc1cc(O)c4c(c1)C(=O)C[C@H](c3c(C)cc2c(C(=O)CCC2O)c3O)[C@@H]4O	Octahydroeuclein	517
[H][C@]7(O[C@H]4CC[C@@]1(C)C(=CC[C@]2([H])[C@]1([H])C[C@@H](OC(=O)/C(C)=C/C)[C@]3(C)[C@@H](C(C)=O)CC[C@]23O)C4)C[C@H](OC)[C@H](O[C@@]6([H])C[C@H](OC)[C@H](O[C@]5([H])O[C@H](C)[C@@H](O)[C@H](OC)[C@H]5O)[C@@H](C)O6)[C@@H](C)O7	Pregn-5-en-20-one, 3-[(O-6-deoxy-3-O-methyl-[beta]-D-glucopyranosyl-(1[to]4)-O-2,6-dideoxy-3-O-methyl-[beta]-D-ribo-hexopyranosyl-(1[to]4)-2,6-dideoxy-3-O-methyl-[beta]-D-ribo-hexopyranosyl)oxy]-14-hydroxy-12-[[(2E)-2-methyl-1-oxo-2-buten-1-yl]oxy]-, (3[b	454
C[C@@]12C[C@@H](CC(=C)[C@H]1C[C@@H]3[C@H](C2)OC(=O)C3=C)O	Ivalin	871
CC1(C2CCC(=C)C1C2)C	Beta-pinene	1065
C[C@@]1(CC[C@H]2[C@@]3(CCCC([C@H]3CC[C@@]2(O1)C)(C)C)C)C=C	8[alpha],13-Epoxylabd-14-ene 	1038
COc2ccc(/C=C/c1cc(O)c(OC)c(OC)c1)cc2OC	Combretastatin A-6	683
COc1cc2oc(=O)ccc2cc1O	Isoscopoletin	758
C1=CC(=C(C=C1C2=CC(=O)C3=C(O2)C=C(C(=C3O)[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)O)O	Isoorientin	866
[H][C@]12C[C@@H](OC)C=C[C@]15CCN2Cc4cc3OCOc3cc45	Epibuphanisine	325
[H][C@@]56C[C@H](O)[C@@]4(C)C(=O)[C@H](OC(C)=O)C7=C(C)[C@@H](OC(=O)[C@H](O)[C@@H](NC(=O)c1ccccc1)c2ccccc2)C[C@@](O)([C@@H](OC(=O)c3ccccc3)[C@]4([H])[C@]5(OC(C)=O)CO6)C7(C)C	Paclitaxel	296
C[C@]12CC[C@@H](CC1=CCC3C2CC[C@]4([C@@]3(CCC4C5=CC(=O)OC5)O)C)O	Xysmalogenin	907
C/C(=C\C=O)/C=C/C(Cl)C(C)(Cl)CBr	(-)-8-Bromo-6,7-dichloro-3,7-dimethyl-2E,4E-octadienal	204
O=c3c2NC=CC1(C=C(Br)C(O)C(Br)=C1)c2c5=NCCc4c(Br)[nH]c3c45	14-bromo-7,8-dehydro-3-dihydro-discorhabdin C	123
C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O[C@H]4[C@@H]([C@H]([C@H]([C@H](O4)CO)O)O)O)O)O	Hyperoside	847
C[C@]12CC[C@@H](C([C@@H]1CC[C@@]3([C@@H]2CC[C@@]4(C3=CC[C@@]5([C@H]4CC(CC5)(C)C)C(=O)O)C)C)(C)C)O	Maprounic acid	877
COC(=O)C[C@@H]1[C@]2(C)[C@@H](O[C@@H]3[C@H]2C(=C)C2=CC[C@@H]([C@@]2([C@H]3OC(=O)C)C)c2cocc2)CC(=O)C1(C)C	Turraflorin G	812
C[C@@H]1CC[C@@]2([C@H]([C@H]3[C@@H](O2)C[C@@H]4[C@@]3(CC[C@H]5[C@H]4CC=C6[C@@]5(CC[C@@H](C6)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O[C@H]8[C@@H]([C@@H]([C@H]([C@@H](O8)C)O)O)O)O)O[C@H]9[C@@H]([C@@H]([C@H]([C@@H](O9)C)O)O)O)C)C)C)NC1	Solamargine	869
COC1=C(C(=CC2=C1C=CC(=O)O2)O)OC	Umckalin	927
COC1=CC2=C(C(=C1)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO[C@H]4[C@@H]([C@H]([C@@H](CO4)O)O)O)O)O)O)C(=O)C=C(O2)C5=CC=C(C=C5)O	Yuankanin	1033
[H][C@@]12C=C(CO)CCC=C(COC(C)=O)CC[C@@]1([H])C(=C)C(=O)O2	Cyclodeca[b]furan-2(3H)-one, 6-[(acetyloxy)methyl]-3a,4,5,8,9,11a-hexahydro-10-(hydroxymethyl)-3-methylene-, [3aS-(3aR*,6Z,10Z,11aS*)]- (9CI)	660
CC1=C([C@]2(CCCC([C@@H]2[C@@H]([C@H]1OC(=O)C)OC(=O)C)(C)C)C)CC/C(=C/COC(=O)C)/C	6[beta],7[alpha],15-triacetoxylabda-8,13E-diene	232
COC1=C(C2=C(C=C1)OC(=CC2=O)C3=CC=CC=C3OC)OC	2',5,6-Trimethoxyflavone	1030
CC(C)[C@@H]\1CCC(=C)[C@@H](CCC(=C)/C=C1)O	4(15),5,10(14)-germacratrien-1-ol	1039
CC1=C(C2=C(C=C1)C(=O)C3=CC=CC=C3C2=O)O	1-hydroxy-2-methylanthraquinone	875
CO[C@]2(C/C=C(C)\C)C(=O)[C@@](O)(C(=O)/C=C/c1ccccc1)C(=O)C(C/C=C(C)\C)=C2O	Microfolian	530
[H][C@@]35C=C[C@@]2([H])[C@]1(C)C[C@@H](O)[C@]([H])([C@H](C)N(C)C)[C@@]1(C)CC[C@]24C[C@]34C[C@@H](O)[C@H](N(C)C)C5(C)C	Cyclonataminol	598
[H][C@@]12CC[C@H](C=C)[C@@]1(C)C[C@@H](O)[C@@]4([H])[C@@]2([H])[C@H](OC(C)=O)C=C3C[C@H](OC(C)=O)CC[C@@]34C	Pregna-5,20-diene-3[alpha],7[alpha],11[alpha]-triol 3[alpha],7[alpha]-diacetate	171
CC1=CC[C@@H](CC1)[C@@](C)(CCC=C(C)C)O	Bisabolol	919
CCC[C@H](C)C[C@H](C)C[C@H](C)/C=C(C)/C(=O)O	Tetramethyl undecenoic acid	166
[H][C@]45CC[C@]2([H])[C@]([H])(CC[C@]3(C)[C@@H](c1ccc(=O)oc1)[C@@H](O)C[C@]23[H])[C@@]4(C)CC[C@H](O)C5	3[beta],16[beta]-dihydroxy-5[beta]-bufa-20,22-dienolide	818
CC(=CCC1=C2C(=CC(=C1OC)OC)C=CC(=O)O2)C	O-Methylcedrelopsin	1021
CC(=C)C(CC1=C(C=C2C(=C1OC)C=CC(=O)O2)OC)O	Toddanone	1022
C/C(=C/C(Cl)Cl)C(Br)/C=C/C(C)(Cl)CBr	Plocoralide C	217
C1=CC=C2C(=C1)C(=CN2)C(=O)C3=NC=C(N3)C4=CNC5=C4C=CC(=C5)Br	Bromodeoxytopsentin	415
CC(=CCOC1=CC(=C2C(=C1)C=C3CC(CC(=O)C3=C2O)(C)O)O)C	Deacetylvismione H	959
C/C(=C/Br)/C=C/[C@H](Cl)[C@@](C)(Cl)/C=C\Br	1,3,7-Octatriene, 1,8-dibromo-5,6-dichloro-2,6-dimethyl-, (1Z,3E,5R,6R,7E)	272
O=c4c2NCCC13C=C(Br)C(O)C(C1)[N+]6=c(c23)c5c(c[nH]c45)CC6	Discorhabdin V	124
[H][C@@]%10(O[C@H]9CO[C@@]([H])(O[C@@H]7C[C@H](O)CC6=CC[C@]1([H])[C@]([H])(CC[C@@]5(C)[C@@]1([H])C(=O)[C@]4([H])O[C@@]3(OC[C@H](C)[C@H](O[C@]2([H])O[C@H](C)[C@H](O)[C@@H](O)[C@H]2O)[C@@H]3O)[C@@H](C)[C@@]45[H])[C@]67C)[C@H](O[C@]8([H])O[C@@H](C)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]8OC(C)=O)[C@H]9O)OC[C@@H](O)[C@H](O)[C@H]%10O	Ornithosaponin D	687
C1=CC(=C(C(=C1)O)C(=O)CCCCCCCCC2=CC(=C(C=C2)O)O)O	Malabaricone c	861
C1[C@H]([C@H](OC2=CC(=CC(=C21)O)O)C3=CC(=C(C(=C3)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O	(-)-Epigallocatechin gallate	997
[H][C@]15CN(C)[C@@]2([H])CC(OC)=CC[C@@]12c4cc3OCOc3cc4[C@@H](OCC)O5	Ethoxyprecriwelline	326
COc2cc(O)cc3OC[C@@H](Cc1ccc(O)cc1)C(=O)c23	4'-Demethyl-5-O-methyl-3,9-dihydroeucomin	336
CO[C@@]1(C)C=C[C@@H](C(C)C)CCC2=C[C@H](CC(C)=CCC1)OC2=O	(-)-(1R*,4R*,10R*)-4-Methoxycembra-2E,7E,11Z-trien-20,10-olide	536
CC1=C([C@]2(CCC(=O)C(C2=C(C1=O)O)(C)C)C)CC[C@H]3[C@@]4(CCC(=O)C(O[C@H]4CC[C@]3(C)O)(C)C)C	Sodwanone A	235
C[C@@]1(C[C@H]([C@]2([C@@H]1[C@@H](OC=C2)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)O)O)OC(=O)/C=C/C4=CC=CC=C4	Harpagoside	1001
CC(C)c4cc3=CC=C2[C@@](C)(COC(=O)c1ccc(O)c(O)c1)CCC[C@]2(C)c3c(O)c4=O	11-Hydroxy-19-(3,4-dihydroxybenzoyloxy)-abieta-5,7,9(11),13-tetraene-12-one	373
CC(=CCC/C(=C/CO)/C)C	Geraniol	1063
[H][C@]15C[C@H](OC)C=C[C@]14c3cc2OCOc2cc3CO[C@]4(O)CN5C	Tazettine	310
C=CC(/C=C/c1ccc(O)cc1)c2ccc(O)cc2	(-)-(E)-1,3-bis(4-hydroxyphenyl)-1,4-pentadiene	564
C[C@H]1COC2=C1C(=O)C(=O)C3=C2C=CC4=C3CCCC4(C)C	"Cryptotanshinone	"	822
CC1=CC(=C(C2=C1C(=O)C=C(O2)CC(=O)C)[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)OC(=O)/C=C/C4=CC=C(C=C4)O)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O	"Aloeresin C	"	1049
O=C1OC2CCN3(=O)C2C(=CC3)COC(=O)C(C(CC21OC2C)C)(C)O	Jacobine N-oxide	785
[H][C@@]12[C@H](OC(C)=O)[C@@H](OC(C)=O)C(C)=C(CC/C(C)=C/CO)C1(C)C[C@@H](OC(C)=O)CC2(C)C	2[alpha],6[beta],7[alpha]-Triacetoxylabda-8,13-dien-15-ol	230
[H][C@]34CN1CC[C@H](O)[C@@H](O)[C@@]1([H])[C@]([H])(CN2C(=O)CCC[C@@]23[H])C4	Calpurmenine	815
Oc1c(O)c(O[CH3])ccc1/C=C\c2cc(O[CH3])c(O[CH3])c(O[CH3])c2	Combretastatin A-1	708
[H][C@]23CC[C@@]14C=C[C@@](C)(CC[C@@]1([H])[C@]2(C)CC[C@@H](O)C3(C)C)C4	Stachenol	690
CC(C)=CCc4c(O)cc3occ(c2cc1C=CC(C)(C)Oc1cc2O)c(=O)c3c4O	Kraussianone 2	344
C[C@]1(O)C=CC[C@@](C)(O)C=C[C@@](O)(C(C)C)CCC2=C[C@H](C1)OC2=O	(+)-(1S*,4R*,8S*,10R*)-1,4,8-Trihydroxycembra-2E,6E,11Z-trien-20,10-olide	699
CC[C@H]([C@@H]1CCCCN1)O	Conhydrine	803
C/C(=C\C=C(Cl)\C(C)=C\C=N\OCc1c(F)c(F)c(F)c(F)c1F)CCl	2,4,6-Octatrienal, 4,8-dichloro-3,7-dimethyl-, O-[(2,3,4,5,6-pentafluorophenyl)methyl]oxime, (2E,4Z,6E)-	209
C[C@H]1[C@H]2C[C@@H]3[C@]4([C@]2(CO[C@]15[C@@H](CC(O5)(C)C)O)C(=O)C[C@]6([C@H]4CC[C@@H]7[C@@]6(CC8=NC9=C(C[C@]1([C@H](C9)CC[C@@H]2[C@@H]1C[C@H]([C@]1(C2=C[C@H]2[C@@]1([C@@H]([C@@]1(O2)[C@@H](C[C@@](O1)(C)CO)O)C)O)C)O)C)N=C8C7)C)O)O3	Cephalostatin 4	480
CC1(C)CCC[C@@](C)(C1)c2ccc3c4c2[C@@H](C)C(=O)O[C@@H]4O[C@H]3OC(C)=O	Aplysulphurin-1	236
[H][C@@]6(O[C@H]5CC[C@@]1(C)C(=CC[C@]2([H])[C@]1([H])CC[C@@]4(C)[C@@]2([H])C[C@H](O[C@]3([H])O[C@@H](C)[C@H](O)[C@@H](OC(C)=O)[C@H]3O)[C@]4([H])[C@H](C)[C@@H](O)C/C=C(C)/C)C5)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O	(22S)-3[beta]-[([beta]-D-glucopyranosyl)oxy]-22-hydroxycholesta-5,24-dien-16[beta]-yl 3-O-acetyl-[alpha]-L-rhamnopyranoside	393
COc3cc2OC[C@@H](Cc1ccc(O)cc1)C(=O)c2c(O)c3O	(R)-5,6-Dihydroxy-7- methoxy-3-(4'-hydroxybenzyl)chroman-4-one	225
COC1=CC2=C(OC3=C(O)C=CC(O)=C3C2=O)C=C1	1,4-Dihydroxy-7-methoxy-xanthone	979
[H][C@@]12CC[C@H](O)C(C)(C)C1=CC[C@@]4([H])[C@@]2(C)CC[C@@]5(C)[C@]3([H])CC(C)(C)CC[C@]3(C)CC[C@]45C	[alpha]-Glutinol	700
CC=C1CC(=C)[C@@](C)(O)C(=O)OCC2=CCN3(=O)[C@H]2[C@H](OC1=O)CC3	Seneciphylline N-oxide	786
[H][C@@]12[C@@H](CO)CCN1CC[C@H]2OC(=O)/C(C)=C\C	7-angelylhastanecine	108
C[C@H](C1(O)C[C@@H](C)[C@@](C)(O)C(=O)OCC2=CCN3(=O)[C@H]2C(OC1=O)CC3)Cl	Jaconine N-oxide	801
[H][C@@]9(O[C@H]8[C@@H](O)CO[C@@]([H])(O[C@H]7C[C@@]6([H])[C@]5([H])CC=C4C[C@@H](O[C@]3([H])O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O[C@]1([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]4(C)[C@@]5([H])CC[C@]6(C)[C@@]7(O)[C@H](C)C(=O)CCC(C)C)[C@@H]8OC(C)=O)OC[C@@H](O)[C@H](O)[C@H]9OC(=O)c%10ccc(OC)c(OC)c%10	3[beta]-[(O-[beta]-D-Glucopyranosyl-(1[to]4)-O-[beta]-D-glucopyranosyl-(1[to]6)-[beta]-D-glucopyranosyl)oxy)]-17[alpha]-hydroxy-16[beta]-[(O-(2-O-3,4-dimethoxybenzoyl-[beta]-D-xylopyranosyl)-(1[to]3)-2-O-acetyl-[alpha]-L-arabinopyranosyl)oxy]cholest-5-...	693
C[C@@H]1C(=O)OC2C=C(CO)CCC=C(C=O)C[C@H](O)C12	Cyclodeca[b]furan-6-carboxaldehyde, 2,3,3a,4,5,8,9,11a-octahydro-4-hydroxy-10-(hydroxymethyl)-3-methyl-2-oxo-, (3S,3aR,4S,6E,10Z,11aR)-	658
CC1=CCC[C@@](C)(O)C=C[C@@](O)(C(C)C)CCC2=C[C@H](C1)OC2=O	(-)-(1S*,4S*,10R*)-1,4-Dihydroxycembra-2E,7E,11Z-trien-20,10-olide (3)	538
CC%10C%13CC(O)c%12c9CCC8Cc7nc6CC5(C)C(CCC4C3=CC2OC1(OC(C)(CO)CC1O)C(C)C2(O)C3(C)C(O)CC45)Cc6nc7CC8(C)c9cc(OC%10%11OC(C)(C)CC%11O)c%12%13	Cephalostatin 6	449
Cc3cc4c7c1C[C@H](C)O[C@H](C)c1c(O)c6c(=O)c(C)cc(c5c2C[C@H](C)O[C@H](C)c2c(=O)c(c3O)c45)c67	Scutiaquinone B	585
COC1=CC=C(C=C1)C2=CC(=O)C3=C(C(=C(C=C3O2)OC)OC)O	Salvigenin	982
Cc4cc(O)c3c(=O)c(c1c(C)cc(O)c2c(=O)ccc(=O)c12)cc(=O)c3c4	Neodiospyrin	438
Clc1c[nH]c2cc(Br)ccc12	6-bromo-3-chloroindole	303
COC1=C(C(=C2C(=C1)OC(=CC2=O)C3=CC=C(C=C3)O)O)OC	Cirsimaritin	998
C=C[C@H]3[C@@H](OC(C)=O)CC4C2CCC1C[C@H](OC(C)=O)C=C[C@]1(C)C2CC[C@]34C	3[alpha],16[beta]-Dihydroxy-5[alpha]-pregna-1,20-diene 3,16-diacetate	148
[H][C@]12C(=C)CCN1CC[C@H]2OC(=O)/C(C)=C\C	7[beta]-angelyl-1-methylene-8[alpha]-pyrrolizidine	115
COC(=O)C[C@@H]1[C@](C)(C=CC(=O)C1(C)C)[C@H]1[C@@H](OC(=O)C)[C@H](OC(=O)C)[C@@]2(C(=CC[C@@H]2C2=CC(=O)OC2O)C1=C)C	Turraflorin E	810
C/C=C\1/CC(=C)[C@@](C(=O)OCC2=CCN3[C@H]2[C@@H](CC3)OC1=O)(C)O	Seneciphylline	622
COc3cc(C)c2c(=O)c1c(O)c(OC)c(O)cc1oc2c3	Drimiopsin F	475
Cc1cc(O)c2c(c1)[C@@H](C(C)C)CC[C@@H]2C	(+)-8-Hydroxycalamenene	740
CC3=CC(=O)C(C(C)C)C4C=C(C)C1(O)C=CC(C)(O1)C(OC(=O)Cc2ccccc2)CC34	Valdivone B	734
COc3ccc(CC2COc1c(OC)c(O)cc(O)c1C2=O)cc3	4'-O-Methyl-3,9-dihydropunctatin	268
O=C(c1c(O)cc(O)cc1OC)\C=C\c2ccccc2	Cardamonin	104
CCC1=CC=CC(=C1N(C(C)COC)C(=O)CCl)C	Metolachlor	946
C=C(C)C1=CC=C(C)CCC=C(C)CC2C=C(CC1)C(=O)O2	(+)-(10R*)-Cembra-1Z,3Z,7E,11Z,15-pentaen-20,10-olide	540
C/C(=C\C[C@H]1C(=C)CC[C@@H]2[C@@]1(CCC[C@@]2(C)C(=O)O)C)/C=C	(+)-trans-ozic acid	440
CC(=O)O[C@@H]1[C@H](C=C2CCN3[C@H]2[C@@H]1c4cc(c(cc4C3)O)OC)O	Sternbergine	654
C[C@@H]1[C@]2([C@@H](C[C@@](O2)(C)CO)O)O[C@@H]3[C@]1([C@]4([C@@H](C[C@H]5[C@H](C4=C3)CC[C@@H]6[C@@]5(CC7=C(C6)N=C8C[C@]9([C@@H](CC[C@@H]1[C@@H]9C[C@H]([C@]2(C1=C[C@H]1[C@@]2([C@@H]([C@@]2(O1)[C@@H](C[C@@](O2)(C)CO)O)C)O)C)O)CC8=N7)C)C)O)C)O	Cephalostatin 12	486
C[C@]12CC[C@@H](CC1=CC[C@@H]3[C@@H]2CC[C@]4([C@@]3(CC[C@@H]4C5=CC(=O)OC5)O)C)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O)O	Xysmalorin	905
C/C(=C\Cc1cc(O)c(C)cc1O)CC/C=C(C)/CC(=O)CC(C)C	6,10-Dodecadien-4-one, 12-(2,5-dihydroxy-4-methylphenyl)-2,6,10-trimethyl-, (6E,10E)-	717
CC(C)C1=C(C(=C2C(=C1)[C@H]([C@@H]3[C@@H]4[C@@]2(CCCC4(C)C)C(=O)O3)OC)O)O	7[beta]-Methoxyrosmanol	985
c1cc(ccc1[C@@H]2[C@@H](Cc3c(cc(cc3O2)O)O)O)O	Afzelechin	643
C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O[C@H]4[C@@H]([C@H]([C@H]([C@H](O4)CO)O)O)O)O	Trifolin	841
C/C(C)=C\Cc5c(O)cc4OC3Oc2cc1OC(C)(C)C=Cc1cc2C3(O)C(=O)c4c5O	Kraussianone 5	348
CN1CC(O)CC1C(O)=O	4-hydroxyhygric acid	1133
[H][C@]12OC(=O)C(=C)[C@]1([H])[C@@H](OC(=O)C(=C)CO)C[C@](C=C)(COC(C)=O)[C@@H]2C(=C)C=O	Vernangulide B	201
[H][C@@]45CCC1=C(CC[C@@]2(C)[C@@]1(C)C(=O)C[C@@]23O[C@H](C(=O)CC)C[C@H]3C)[C@@]4(C)CC[C@H](O)[C@]5(C)CO	Eucosterol	525
CCCC2C=CC(CCCC1(O[CH3])C=CC(CC(=O)O[CH3])OO1)OO2	1,2-Dioxin-3-acetic acid, 6-[3-(3,6-dihydro-6-propyl-1,2-dioxin-3-yl)propyl]-3,6-dihydro-6-methoxy-, methyl ester	723
O=c3c2NCCC1(C=CC(O)C=C1)c2c5=[NH+]CCc4c[nH]c3c45	2,4-Debromo-3-dihydro-discorhabdin C	127
COc3ccc(CC2COc1cc(OC)cc(O)c1C2=O)cc3	5-hydroxy-7-methoxy-3-(4-methoxybenzyl)chroman-4-one	613
COC(=O)C[C@@H]1[C@](C)([C@@H](O)CC(=O)C1(C)C)[C@H]1[C@@H](OC(=O)C)[C@H](OC(=O)C)[C@@]2(C(=CC[C@@H]2c2cocc2)C1=C)C	Turraflorin H	813
C=C[C@](C)(Cl)[C@@H](Cl)/C=C/C(C)=C\Br	(1Z,3E,5S*,6S*)-1-bromo-5,6-dichloro-2,6-dimethyl-octa-1,3,7- triene	259
O=c4c2[nH]cc1CCN=c(c12)c5c(c3ccc(O)cc3)c[nH]c45	Tsitsikammamine A	136
COC1=CC(=C(C(=C1)O)C(=O)CCC2=CC=CC=C2)O	2',6'-Dihydroxy-4'-methoxydihydrochalone	1015
[H][C@]12[C@H](O)CCN1CC[C@@H]2COC(=O)/C(C)=C\C	9-angelylhastanecine	109
[H][C@]13CC=CC(=O)[C@]1(C)C[C@]2([H])OC(=O)C(C)=C2C3	4a[alpha]H-3,5[alpha],8[beta]a- trimethyl-4,4a,8a,9-tetrahydronaphtho-([2,3b]-dihydrofuran-2-one)-8-one	353
C/C(=C\C=C(Cl)\C(C)=C\C=O)CCl	2,4,6-Octatrienal, 4,8-dichloro-3,7-dimethyl-, (2E,4Z,6E)-	203
C/C(=C\CC(Br)/C(C)=C/C=O)CCl	(-)-4-Bromo-8-chloro-3,7-dimethyl-2E,6E-octadienal	205
[H][C@@]23C=C4CC[C@H]1OC1(C[C@H](OC(=O)C(=C)C)[C@@]2([H])C(=C)C(=O)O3)C(O)OC4	Vernolide	300
CC1=CC2=C(C(=C1)O)C(=O)C=C(C2=O)C3=C(C4=C(C=C3C)C(=O)C=CC4=O)O	Diospyrin	434
[H][C@@]12CC(OC)=CC(=O)[C@]13CC[N@]2Cc5c3cc4OCOc4c5OC	Distichamine	345
C1CNC2=CC(=O)C(=O)C3=C2C1=CN3	Damirone C	238
COc2c(OC)c1sssc1c(CCN(C)C)c2SC	3,4-dimethoxy-6-(2'-N,N- dimethylaminoethyl)-5-(methylthio)bemtrithian	453
C1=CC(=CC=C1/C=C/C(=O)NCCC2=CNC3=C2C=C(C=C3)O)O	N-coumaroyl serotonin	1112
COc3cc(O)c2C(=O)[C@H](Cc1ccc(O)cc1)COc2c3	5-hydroxy-3-(4-hydroxybenzyl)-7-methoxy-4-chromanone	688
COc2c(O)cc(O)c3C(=O)[C@H](Cc1ccc(O)cc1)COc23	3,9-Dihydropunctatin	260
[H][C@@]6(O[C@@H]5C[C@H](O)CC4=CC[C@]1([H])[C@]([H])(CC[C@@]3(C)[C@@]1([H])C[C@H](O[C@]2([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@]3([H])[C@H](C)[C@@H](O)C/C=C(C)/C)[C@]45C)O[C@@H](C)[C@H](O)[C@@H](O)[C@H]6O	(22S)-3[beta],22-Dihydroxy-1[beta]-[([alpha]-L-rhamnopyranosyl)oxy]cholest-5,24-dien-16[beta]-yl [beta]-D-glucopyranoside	495
C1=CC2=C(C=C1O)NC=C2C(=O)C3=NC(=CN3)C4=CNC5=C4C=CC(=C5)Br	Bromotopsentin	413
C=C[C@](C)(Cl)[C@H](Cl)/C=C/C(C=O)=C\Cl	3,7-Octadienal, 5,6-dichloro-2-(chloromethylene)-6-methyl-, (2E,3E,5S,6R)-	255
C=C1C(=O)OC2CCN3C2C(=CC3)COC(=O)C(C(C1C)C)(C)O	Senecivernine	789
[H][C@@]34CC[C@]2([H])[C@](O)(C=C[C@H](NC(=O)c1ccccc1)[C@@]2(C)CO)CC3=CC[C@@]5(C)[C@@]4(C)C[C@@H](OC(C)=O)[C@]5([H])[C@H](C)N(C)C	Buxalongifolamidine	601
C1=CC(=C(C=C1C2=CC(=O)C3=C(C=C(C=C3O2)O)O)O)O	Luteolin	992
O=c3cc(c1ccc(O)cc1)c(=Cc2ccc(O)cc2)o3	Rubrolide E	313
[H][C@@]8(OC4C[C@@]3([H])[C@]2([H])CC=C1C[C@@H](O)CC[C@]1(C)[C@@]2([H])CC[C@]3(C)[C@@]4(O)[C@H](C)C(=O)CCC(C)C)OC[C@H](O)[C@H](O[C@]6([H])OC[C@@H](OC5OC(CO)[C@@H](O)C(O)[C@H]5O)[C@H](O)[C@H]6OC(=O)c7ccc(OC)c(OC)c7)[C@H]8OC(C)=O	3[beta],17[alpha]-dihydroxy-16[beta]-[(O-[beta]-D-glucopyranosyl-(1[to]4)-O-(2-O-3,4-dimethoxybenzoyl-[beta]-D-xylopyranosyl)-(1[to]3)-2-O-acetyl-[alpha]-L-arabinopyranosyl)oxy]cholest-5-en-22-one	500
C1[C@@H]([C@H](OC2=C1C(=CC(=C2[C@@H]3[C@H]([C@H](OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)O)O)O)C6=CC(=C(C=C6)O)O)O	Procyanidin B1	996
COC1=C(C2=C(C(=C1)CCN)SSSSS2)OC	Varacin	451
[H][C@@]47CC[C@]1([H])[C@]([H])(CC[C@@]3(C)[C@@]1([H])C[C@H](O[C@]2([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@]3([H])[C@H](C)[C@@H](O)C/C=C(C)/C)[C@@]4(C)[C@H](O[C@]6([H])O[C@H](COC(=O)c5cc(OC)c(OC)c(OC)c5)[C@@H](O)[C@H](O)[C@H]6O)C[C@H](O)C7	(22S)-16[beta]-[([beta]-D-glucopyranosyl)oxy]-3[beta],22-dihydroxy-5[alpha]-cholest-24-en-1[beta]-yl 6-O-(3,4,5-trimethoxybenzoyl)-[beta]-D-glucopyranoside	405
Cc2cc(C(=O)O)c1CC(C)C(=O)c1c2	2,6- dimethyl-1-oxo-4-indanecarboxylic acid	332
CC(=O)Cc4cc(=O)c3c(C)cc(O)c([C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1OC(=O)/C=C/c2ccc(O)cc2)c3o4	Aloeresin A	711
CC1=CCCC(C1/C=C/C(=O)C)(C)C	[alpha]-ionone	928
[H][C@]23CCC(=C)[C@]1([H])[C@H](OC(C)=O)OC=C(C(C/C=C(C)/C)OC(C)=O)[C@@]1([H])CC[C@]2(C)O3	Tsitsixenicin B	150
C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OC2=C(OC3=CC(=CC(=C3C2=O)O)O)C4=CC(=C(C(=C4)O)OC)O)O)O)O	Mearnsitrin	1089
COC(=O)C[C@@H]1[C@](C)(C=CC(=O)C1(C)C)[C@H]1[C@@H](OC(=O)C)[C@H](OC(=O)C)[C@@]2(C(=CC[C@H]2c2cocc2)C1=C)C	Turraflorin A	807
O=c3cc(c1ccc(O)c(Br)c1)c(=Cc2ccc(O)cc2)o3	3'-bromorubrolide E	307
C1=C(C=C2C(=C1O)OC3=CC(=CC(=C3O2)O)O)O	Dibenzo-1,4-dioxin-1,3,6,8-tetraol	986
O=C2C(\O[C@@H]1O[C@H]([C@@H](O)[C@@H](O)[C@@H]1O)C)=C(/Oc3cc(O)cc(O)c23)c4ccc(O)c(O)c4	Quercetrin-3-O-rhamnoside	107
[H][C@@]7(O[C@H]4C[C@@]3([H])[C@]2([H])CC=C1C[C@@H](O)CC[C@]1(C)[C@@]2([H])CC[C@]3(C)[C@@]4(O)[C@H](C)C(=O)CCC(C)C)OC[C@H](O)[C@H](O[C@]5([H])OC[C@@H](O)[C@H](O)[C@H]5OC(=O)c6ccc(OC)c(OC)c6)[C@H]7OC(C)=O	3[beta],16[beta],17[alpha]-trihydroxy-cholest-5-en-22-one 16-O-(2-O-3,4-dimethoxybenzoyl-[beta]-d-xylopyranosyl)-(1[to]3)-(2-O-acetyl-[alpha]-l-arabinopyranoside)	391
COc3cc(O)c2C(=O)[C@H](Cc1ccc(O)cc1)COc2c3OC	7-O-methyl-3,9-dihydropunctatin	356
CC12CCC(CC1CCC3C2CCC4(C3(CCC4C5=CC(=O)OC5)O)C)OC6C(C(C(C(O6)COC7C(C(C(C(O7)CO)O)O)O)O)O)O	Uzarin	904
C[C@H]1[C@H]2CC=C3[C@]2(CO[C@]14[C@@H](CC(O4)(C)C)O)C(=O)C[C@]5([C@H]3CC[C@@H]6[C@@]5(CC7=C(C6)N=C8[C@@H]([C@]9([C@@H](CC[C@@H]1[C@@H]9C[C@H]([C@]2(C1=C[C@H]1[C@@]2([C@@H]([C@@]2(O1)[C@@H](C[C@@](O2)(C)CO)O)C)O)C)O)CC8=N7)C)OC)C)O	Cephalostatin 10	484
[H][C@@]23C[C@@H](C)C=CC=CC[C@@]1([H])O[C@]([H])(C[C@H]1C)[C@H](O)C[C@@]4([H])OC(=O)[C@](O)([C@H](OC(=O)CCC)C[C@@]([H])(C[C@@H](O)C2)O3)[C@@]4([H])OC(=O)CCC	Mandelalide D	295
COc3ccc(CC2(O)COc1cc(OC)c(O)c(O)c1C2=O)cc3O	3,5,6-trihydroxy-7-methoxy-3-(3'-hydroxy-4'-methoxybenzyl)-4-chromanone	569
[H][C@@]6(O[C@@H]5C[C@H](O)CC4=CC[C@]1([H])[C@]([H])(CC[C@@]3(C)[C@@]1([H])C[C@H](O[C@]2([H])O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)[C@]3([H])[C@H](C)[C@@H](O)CC=C(C)C)[C@]45C)O[C@@H](C)[C@H](O)[C@@H](O)[C@H]6O	(22S)-16[beta]-[([alpha]-L-rhamnopyranosyl)oxy]-3[beta],22-dihydroxycholesta-5,24-dien-1[beta]-yl [alpha]-L-rhamnopyranoside	669
C=CC3CCC4C2CCC1CC(=O)C=C[C@]1(C)C2CC[C@]34C	5[alpha]-Pregna-1,20-dien-3-one	146
[H][C@]2([C@H](C)CC[C@H](O)C(C)(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)CC[C@]5(C)[C@]2(C)CC[C@@]36C[C@@]34C(=O)C=CC(C)(C)[C@]4([H])C[C@H](O)[C@@]56[H]	Sutherlandioside D	548
COc2ccc(CCc1cc(O)c(OC)c(OC)c1)cc2O	Combretastatin B-2	675
[H][C@@]%10(O[C@H]9CO[C@@]([H])(O[C@@H]7C[C@H](O)CC6=CC[C@]1([H])[C@]([H])(CC[C@@]5(C)[C@@]1([H])C(=O)[C@]4([H])O[C@@]3(OC[C@H](C)[C@H](O[C@]2([H])O[C@H](C)[C@H](O)[C@@H](O)[C@H]2O)[C@@H]3O)[C@@H](C)[C@@]45[H])[C@]67C)[C@H](O[C@]8([H])O[C@@H](C)[C@H](O)[C@@H](O)[C@H]8O)[C@H]9O)OC[C@@H](O)[C@H](O)[C@H]%10O	Ornithosaponin C	686
CN1CCC2=CC3=C(C4=C2[C@@H]1CC5=CC6=C(C=C54)OCO6)OCO3	Neolitsine	1094
C1=C(C=C(C(=C1O)O)O)C(=O)O	Gallic acid	849
O=c1ccc2c(o1)cc(c(c2)O)O	Esculetin	756
[H][C@@]34CC[C@H](C)[C@H](CCC1=C(C)C(=O)C(O)=C2C(C)(C)C(=O)CC[C@@]12C)[C@@]3(C)CCC(=O)C(C)(C)O4	Sodwanone B	594
C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)C(=O)O)O)O)O)O)O	Quercituron	842
CC1C(=O)OC2(C)C1C(=O)OC3CCN4CC=C(COC(=O)C2(C)O)C34	Grantianine	761
[H][C@@]57CC[C@]1([H])[C@]([H])(CC[C@@]4(C)[C@@]1([H])C[C@H](O[C@]3([H])O[C@H](COC(C)=O)[C@@H](O[C@]2([H])OC[C@](O)(CO)[C@H]2O)[C@H](O)[C@H]3O)[C@]4([H])[C@H](C)[C@@H](O)CCC(C)C)[C@@]5(C)[C@H](O[C@]6([H])O[C@@H](C)[C@H](O)[C@@H](O)[C@H]6O)C[C@H](O)C7	(22S)-16[beta]-[(O-[beta]-D-apiofuranosyl-(1[to]4)-6-O-acetyl-[beta]-D-glucopyranosyl)oxy]-3[beta],22-dihydroxy-5[alpha]-cholestan-16[beta]-yl [alpha]-L-rhamnopyranoside	402
COC1=CC(=CC(=C1O)OC)C(=O)OCCCCN=C(N)N	Leonurine	908
COC1=CC(=CC(=C1O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)OC)/C=C/CO	Syringin	1084
[H][C@@]46CC[C@]1([H])[C@]([H])(CC[C@@]3(C)[C@@]1([H])C[C@H](O[C@]2([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@]3([H])[C@H](C)[C@@H](O)CCC(C)C)[C@@]4(C)[C@H](O[C@]5([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)C[C@H](O)C6	(22S)-16[beta]-[([beta]-D-glucopyranosyl)oxy]-3[beta],22-dihydroxy-5[alpha]-cholestan-1[beta]-yl [beta]-D-glucopyranoside	403
CN1CC[C@]2([C@@H]1C[C@@H](CC2)O)C3=CC(=C(C=C3)OC)OC	Mesembrinol	1034
C[n+]1ccc2c(c1)[nH]c1c2cccc1O	8-hydroxy-2-methyl-b-carbolinium	766
CCC1=C(C2=NC1=CC3=C(C4=C([C@@H](C(=C5[C@H]([C@@H](C(=CC6=NC(=C2)C(=C6C)C=C)N5)C)CCC(=O)OC/C=C(C)/CCC[C@H](C)CCC[C@H](C)CCCC(C)C)C4=N3)C(=O)OC)O)C)C	Pheophytin a	886
COC(=O)/C=C/C1=CC(=C(C=C1)O)O	Methyl caffeate	852
COC1=C(C(=C2C(=C1)OC(=CC2=O)C3=CC(=C(C=C3)O)O)O)O	Pedalitin	1127
C[C@@H]1CC[C@@H]2CC3=C(CC[C@]13C2(C)C)C	Cyperene	879
CC1=CCC[C@](C)(O)C=C[C@@](O)(C(C)C)CCC2=C[C@H](C1)OC2=O	(-)-(1S*,4S*,10R*)-1,4-Dihydroxycembra-2E,7E,11Z-trien-20,10-olide (4)	697
[H][C@@]12C=C(COC(C)=O)CCC=C(COC(C)=O)CC[C@@]1([H])C(=C)C(=O)O2	Cyclodeca[b]furan-2(3H)-one, 6,10-bis[(acetyloxy)methyl]-3a,4,5,8,9,11a-hexahydro-3-methylene-, [3aS-(3aR*,6Z,10Z,11aS*)]- (9CI)	659
[H][C@]57Cc2ccc1Oc9c(OCc1c2)c(OC)cc8CCN(C)[C@]([H])(Cc4ccc3Oc6c(OCc3c4)c(OC)cc(CCN5C)c67)c89	Cissacapine	381
"CC1(C2CCC(O1)(CC2)C)C
"	Eucalyptol	902
[H][C@]45CC[C@H](C)[C@]3(O[C@]([H])([C@@]2(C)CC[C@]1([H])OC(C)(C)C(=O)CC[C@]12C)C[C@H]3O)[C@]4(C)CCC(=O)C(C)(C)O5	12R-Hydroxyyardenone	589
C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@@H](O[C@@H]([C@H]2OC(=O)/C=C/C3=CC(=C(C=C3)O)OC)CO)OCCC4=CC(=C(C=C4)OC)O)O)O)O)O	Martynoside	1067
[H][C@]34CCC(C)=C(CCC1=C(C)CC[C@]2([H])OC(C)(C)[C@H](O)CC[C@@]12C)[C@]3(C)CCC(=O)C(C)(C)O4	Sodwanone T	590
[H][C@]34CCC(C)=C(CCC1=C(C)C(=O)C(O)=C2C(C)(C)C(=O)CC[C@]12C)[C@]3(C)CCC(=O)C(C)(C)O4	10,11-Dihydrosodwanone B	588
O=C1N4[C@@]3(C([H])([H])C([H])([H])C1([H])[H])C([H])([H])C([H])([H])C([H])([H])[C@]2(N(C([H])([H])C([H])([H])[C@@]([H])(O[H])C2([H])[H])C3([H])[H])[C@]4([H])O[H]	10,13-Dihydroxylupanine	817
[H][C@]1/2CCC(C)=CCCC(=C)[C@]1([H])COC(=O)C2=C\CC(OC(C)=O)C(=C)C	Xeniolide C	158
C[C@]12CCCC(=C)[C@@H]1C[C@@H](CC2)C(C)(C)O	[beta]-Eudesmol	916
C/C(=C\Cc1cc(O)c(C)cc1O)CCC/C(C)=C\C(=O)CC(C)C	5,10-Dodecadien-4-one, 12-(2,5-dihydroxy-4-methylphenyl)-2,6,10-trimethyl-, (5Z,10E)-	725
COc3cc(O)c2c(=O)c1c(C)cc(O)cc1oc2c3O	Drimiopsin E	470
"CN1CC[C@H]2OC(=O)[C@]3(OC3C)C[C@H]([C@@](C(=O)OCC(=CC1)C2=O)(C)OC(=O)C)C	"	Florosenine	782
[H][C@@]4(O[C@@H]2[C@@H](O)[C@H](OCCc1ccc(O)c(O)c1)O[C@H](CO)[C@H]2OC(=O)/C=C/c3ccc(O)c(O)c3)O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O	Acteoside	370
[H][C@@]7(O[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@@]1([H])OC6CC[C@@]2(C)C(=CC[C@]3([H])[C@]2([H])CC[C@@]5(CO)[C@@]3([H])C[C@]4([H])O[C@@H](O)[C@H](/C=C(C)\C)[C@@H](C)[C@@]45[H])C6)O[C@@H](C)[C@H](O)[C@@H](O)[C@H]7O	(22S,23R)-16[beta],23-epoxy-18,23-dihydroxy-22-(2-methyl-1-propenyl)-24-norchol-5-en-3[beta]-yl O-[alpha]-L-rhamnopyranosyl-(1[to]2)-[beta]-D-glucopyranoside	498
CC(Cl)(/C=C/[C@H](Br)[C@](C)(Cl)/C=C/Br)CBr	1,4,8-Tribromo-3,7-dichloro-3,7-dimethyl-1E,5E-octadiene	207
[H][C@]12C(=C)CCN1CCC2OC(=O)/C(C)=C\C	7[alpha]-angelyl-1-methylene-8[alpha]-pyrrolizidine	113
C[C@H]/1CC[C@@H]2C[C@H](C[C@@](O2)([C@@H]3CSC(=O)N3)O)OC(=O)/C=C(\CC/C=C/C=C1)/C	Latrunculin A	183
COc2ccc(C[C@@H](O)c1cc(OC)c(OC)c(OC)c1)cc2O	Combretastatin	673
C1=CC=C(C=C1)[C@@H]2[C@H](C(=O)C3=C(C=C(C=C3O2)O)O)O	Indole-3-acetic acid	955
C=C(C)C(Br)CC(Br)/C(C)=C/C(Cl)Cl	Plocoralide B	206
O=C(/C=C/c1cccc(O)c1)c2ccc(O)cc2O	(E)-3,2',4'-Trihydroxychalcone	521
CC1=CCC2C(C1)C2(C)C	[gamma]-3-Carene	911
O=C2C(=Cc1ccc(O)cc1)COc3cc(O)cc(O)c23	4'-Demethyl-eucomin	258
[H][C@]14C[C@@H](OC)C=C[C@]15c3cc2OCOc2cc3CN4C[C@@H]5O	Crinamine	318
C[C@@H]1CC[C@@]2([C@@H]([C@@]1(C)CCC3=COC=C3)CCC=C2C(=O)O)C	Hardwickiic acid	995
COc3c(O)cc2oc1cc(O)cc(C)c1c(=O)c2c3O	Drimiopsin C	473
C[C@H](O)[C@@H](O)[C@@H](O)C[C@@H](OC(=O)CCCCCCCCCCCCCCCCCCCC)c2coc(Cc1ocnc1)n2	L-arabino-Hexitol, 1,5-dideoxy-6-C-[2-(5-oxazolylmethyl)-4-oxazolyl]-, 6-heneicosanoate, (6R)- (9CI)	427
[H][C@@]16CC(=O)C(Br)=C[C@]12C[C@H](Nc3c2c5=NCCc4c[nH]c(c3=O)c45)S6	Discorhabdin A	140
[H][C@]24C[C@@H](OC(=O)/C(C)=C/C)[C@]1(C)[C@@H](C(C)=O)CC[C@]1(O)[C@]2(C)CC=C3C[C@@H](O)CCC34	Pregn-5-en-20-one, 3,14-dihydroxy-12-[[(2E)-2-methyl-1-oxo-2-buten-1-yl]oxy]-, (3[beta],12[beta],14[beta])-	456
C=C[C@H]3CCC4C2CC=C1C[C@@H](O)CC[C@]1(C)C2CC[C@]34C	Pregna-5,20-dien-3[beta]-ol	167
C[C@@H]1C[C@@]2([C@H]([C@H]3[C@@H](O2)C=C4[C@@]3([C@@H](C[C@H]5[C@H]4CC[C@@H]6[C@@]5(CC7=NC8=C(C[C@]9([C@H](C8)CC[C@@H]2[C@@H]9C[C@H]([C@]3(C2=C[C@H]2[C@@]3([C@@H]([C@@]3(O2)[C@@H](C[C@@](O3)(C)CO)O)C)O)C)O)C)N=C7C6)C)O)CO)C)OC1(C)C	Cephalostatin 8	482
[H][C@@]5(O[C@H]4C[C@@]3([H])[C@]2([H])CC=C1C[C@@H](O)CC[C@]1(C)[C@@]2([H])[C@H](O)C[C@]3(C)[C@@]4([H])[C@H](C)[C@@H](O)C/C=C(C)/C)O[C@@H](C)[C@H](O)[C@@H](OC(C)=O)[C@H]5OC(C)=O	(22S)-cholesta-5,24-diene-3[beta],11[alpha],16[beta],22-tetrol 16-O-(2,3-di-O-acetyl-[alpha]-L-rhamnopyranoside)	512
C=C1CCC(=O)[C@]2(C)CC[C@@H](C(C)C)C(O)C12	6[alpha]-Hydroxy-4(14)-eudesmen-1-one	224
COc2c(O)cc(C)c3c(=O)c1c(O)cc(O)c(OC)c1oc23	Drimiopsin D	474
CCOCC1=CC(=C(C(=C1Br)Br)O)O	Lanosol ethyl ether	1058
Nc2cc4=NCCc3cn(C1O[C@H](CO)[C@@H](O)[C@H]1O)c(c2=O)c34	N-1-[beta]-D-ribofuranosyl makaluvamine I	251
CN1C2=CC=CC=C2C(=O)C3=C1C=C(C=C3OC)O	Tegerrardin A	608
CC(C)c4cc3=CC=C2C(C)(C)C[C@H](OC(=O)c1ccc(O)c(O)c1)C[C@]2(C)c3c(O)c4=O	Parviflorone F	369
C1=CC(=CC=C1C2=COC3=C(C2=O)C(=CC(=C3[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)O)O	Genistein 8-c-glucoside	1068
C=C[C@](C)(Cl)[C@H](Cl)/C=C/C(C)=C\Br	1,3,7-Octatriene, 1-bromo-5,6-dichloro-2,6-dimethyl-, (1Z,3E,5R,6S)	277
C[C@]12CCCC([C@@H]1CC=C([C@@H]2C=O)C=O)(C)C	Polygodial	650
COc1cc2oc(=O)ccc2cc1OC	Scoparone	757
[H][C@@]8(O[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@@]1([H])O[C@H]6CC[C@@]2(C)C(=CC[C@]3([H])[C@]2([H])CC[C@@]5(CO)[C@@]3([H])C[C@]4([H])O[C@@H](O)[C@H](C=C(C)C)[C@@H](C)[C@@]45[H])C6)O[C@@H](C)[C@H](OC(=O)c7ccc(OC)cc7)[C@@H](O)[C@H]8O	Saundersioside H	672
COC1=C(C=CC(=C1)/C=C/C(=O)O)O	Ferulic acid	953
C=C[C@](C)(Cl)[C@H](Cl)/C=C/C(=C\Cl)C(Cl)Cl	1,3,7-Octatriene, 1,5,6-trichloro-2-(dichloromethyl)-6-methyl-, (1Z,3E,5S,6R)-	254
COC1[C@@H]4C(=O)C=C2S[C@@H]3C[C@@]12c5c(N3)c(=O)c7[nH]cc6CC[N+]4=c5c67	1-Methoxy discorhabdin D	134
"C1=C(C=C(C(=C1O)O)O)C(=O)OC[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)OC(=O)C3=CC(=C(C(=C3)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O)OC(=O)C5=CC(=C(C(=C5)O)O)O)OC(=O)C6=CC(=C(C(=C6)O)O)O
"	Pentagalloylglucose	844
[H][C@@]4([C@]3(O)c1cccc(O)c1C(=O)c2c(O)cc(CO)cc23)O[C@H](COC(C)=O)[C@@H](O)[C@H](O)[C@H]4O	10-Hydroxyaloin B 6'-O-acetate	620
[H][C@@]14C[C@@](C)(C(=O)O)CC[C@]1(C)CC[C@]5(C)[C@@]3([H])CC[C@]2(C)[C@@H](C)C(=O)CC[C@@]2([H])[C@]3(C)CC[C@@]45C	Octandronic acid	553
[H][C@]34CC[C@]12C=C[C@](C)(C1)C(=O)C[C@@]2([H])[C@]3(C)CC(=O)[C@@H](O)[C@@H]4C	ent-3[beta]-Hydroxy-19-nor-beyer15-ene-2,12-dione	305
C1CN2C3=C1C=CC=C3C4=CC5=C(C=C4C2=O)OCO5	Anhydrolycorinone	894
CN1CCC2OC(=O)C(O)(CC(C(C(=O)OCC(=CC1)C2=O)(C)O)C)C(O)C	Onetine	787
CC(=CCC/C(=C\CO)/C)C	Nerol	1064
[H][C@]2([C@H](C)CC[C@H](O)C(C)(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)CC[C@]5(C)[C@]2(C)CC[C@@]36C[C@@]34C(=O)C[C@@H](O)C(C)(C)[C@]4([H])C[C@H](O)[C@@]56[H]	Sutherlandioside B	546
C/C(=C\CCC2(C)C=Cc1cc(O)c(C)cc1O2)CC(=O)CC(C)C	6-Nonen-4-one, 9-(6-hydroxy-2,7-dimethyl-2H-1-benzopyran-2-yl)-2,6-dimethyl-, (6E)-	726
COC1=C2C=CC(=O)OC2=CC3=C1OCO3	 5-Methoxy-6,7-(methylenedioxy)coumarin	961
CC1=C[C@H]2[C@@H](CC[C@@]([C@@H]2CC1)(C)O)C(C)C	Alpha-cadinol	1066
CC=C1C[C@@H](C)[C@@](C)(O)C(=O)OCC2=CCN3(=O)[C@H]2[C@H](OC1=O)CC3	Integerrimine N-oxide	791
COC1=C(C=C2CCN[C@H]3C2=C1C4=CC=CC=C4C3)O	Asimilobine	1103
[H][C@]24CC[C@]1(C)[C@@H](C=C)CC[C@@]1([H])[C@]2([H])[C@H](O)C=C3C[C@H](OC(C)=O)CC[C@@]34C	Pregna-5,20-diene-3[alpha],7[alpha]-diol 3[alpha]-acetate	168
c1ccc2c(c1)c3cc4c(cc3cn2)OCO4	Trisphaeridine	645
[H][C@@]23C[C@@H](OC)[C@@H]1O[C@@H]1[C@]24CCN3Cc6c4cc5OCOc5c6OC	Undulatine	331
[H][C@@]8(O[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@@]1([H])O[C@H]6CC[C@@]2(C)C(=CC[C@]3([H])[C@]2([H])CC[C@@]5(C=O)[C@@]3([H])C[C@]4([H])O[C@@H](O)C(/C=C(C)/C)[C@@H](C)[C@@]45[H])C6)O[C@@H](C)[C@H](OC(=O)c7ccc(O)cc7)[C@@H](O)[C@H]8O	Saundersioside E	388
COC1=C(OC2=CC(=CC(=C2C1=O)O)O)C3=CC=C(C=C3)O	Kaempferol 3-methyl ether	974
CC(C)c4cc3=CC=C2[C@@](C)(COC(=O)c1ccc(O)cc1)CCC[C@]2(C)c3c(O)c4=O	11-Hydroxy-19-(4-hydroxybenzoyloxy)-abieta-5,7,9(11),13-tetraene-12-one	372
C1=CC(=CC=C1/C=C/C(=O)O)O	P-hydroxycinnamic acid	1044
CC1(C)[C@@H](O)CC[C@@]2(C)[C@@]1([H])CC[C@]3(C)[C@]2([H])CC[C@@]4([H])[C@@]3(C)CC[C@]5(C(O)=O)[C@]4([H])[C@H](C(C)=C)CC5	Betulinic acid	743
[H][C@]23C=CCCC[C@@]1([H])O[C@](O)(C[C@H](O)[C@H]1C)[C@@H](O)[C@@H]8O[C@H](CC(=C)C[C@H](O)/C=C/C(=C)Cl)[C@@H](O)[C@H](OC(=O)C[C@@]7([H])C[C@H](O)C[C@@]6(C[C@@](C)(O)C[C@]([H])(C=C5CO[C@H]([C@H](C)C(=O)C[C@]4([H])C[C@H](OC)C[C@](C[C@@H](O)C2)(O3)O4)C5C)O6)O7)C8C	Spongiostatin 5	213
COc2cc(C(=O)OCCc1ccc(O)cc1)ccc2O	4'-hydroxyphenyl ethyl vanillate	368
CC(=O)O[C@H]1O[C@@H](OC(C)=O)[C@@H]2CC[C@@H](C(=C\C)/[C@H]12)C3(C)CCCC(C)(C)C3	9,11-dihydrogracilin A	237
C[C@H]6CC[C@@H]2OC1(O)CCC2(O[C@@]1(C)C)[C@]6(C)CC[C@@]3(C)[C@@H](C)CCC54OC(CCC34)[C@](C)(C)O5	Sodwanone P	420
C1=CC(=C(C(=C1)O)C(=O)CCCCCCCCC2=CC=C(C=C2)O)O	Malabaricone b	862
[H][C@]34CCC(C)=C(CCC12CCC(=O)C(C)(C)C1=C(O)C(=O)C(C)=C2C)[C@]3(C)CCC(=O)C(C)(C)O4	Sodwanone U	591
"C1=CC(=CC=C1C2=CC(=O)C3=C(C=C(C=C3O2)O)O)O
"	apigenin	824
[H][C@]12[C@@H](COC(=O)/C(=C/C)CO)CCN1CC[C@H]2OC(=O)/C(C)=C\C	Neosarracine	117
C=C1C[C@H]2C=C(CC[C@](O)(C(C)C)C=C[C@@](C)(O)CC[C@H]1O)C(=O)O2	(-)-(1S*,4S*,7S*,10R*)-1,4,7-Trihydroxycembra-2E,8(19),11Z-trien-20,10-olide	698
C1=CC(=CC=C1CCC(=O)C2=C(C=C(C(=C2O)[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)O)O)O	Nothofagin	1083
COC(=O)Cc1cc(O)c(C/C=C(C)/CC/C=C(C)/CC(=O)/C=C(C)\C)cc1O	8'-desoxyrietone	161
[H]C1([H])C[C@@]2([H])C(=C)CCC3[C@H](OC(=O)C3=C)[C@@]2([H])C1=C	dehydrocostus lactone	1130
[H][C@]12CCC(C)=CCCC(=C)[C@]1([H])[C@@H](OC(C)=O)OC=C2C(C/C=C(C)/C)OC(C)=O	9-deacetoxy-14,15-deepoxyxeniculin	155
[H][C@@]%10(O[C@H]7C[C@@]6([H])[C@]5([H])CC=C4C[C@@H](O[C@]3([H])O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O[C@]1([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]4(C)[C@@]5([H])CC[C@]6(C)[C@@]7(O)[C@H](C)C(=O)CCC(C)C)OC[C@H](O)[C@H](O[C@]8([H])OC[C@@H](O)[C@H](O)[C@H]8OC(=O)c9ccc(O)c(OC)c9)[C@H]%10OC(C)=O	3[beta]-[(O-[beta]-D-glucopyranosyl-(1[to]4)-O-[beta]-D-glucopyranosyl-(1[to]6)-[beta]-D-glucopyranosyl)oxy)]-17[alpha]-hydroxy-16[beta]-[(O-(2-O-4-hydroxy-3-methoxybenzoyl-[beta]-D-xylopyranosyl)-(1[to]3)-2-O-acetyl-[alpha]-L-arabinopyranosyl)oxy]chol...	506
COC1=CC2=C(OC3=CC=C(O)C(OC)=C3C2=O)C=C1	1,7-Dimethoxy-2-hydroxyxanthone	978
[H][C@@]12CC(OC)=CC[C@]13CC[N@]2Cc5c3cc4OCOc4c5OC	Buphanidrine	339
COC1=CC=C(C=C1)C2=COC3=C(C2=O)C=CC(=C3OC)O	Isoafrormosin	1117
CC1=CC(=O)C=C(C1=O)CC=C(C)C	2-methyl-6-(3-methyl-2-butenyl)benzo-1,4-quinone	1026
[H][C@]12CC=C(COC(C)=O)[C@@]1([H])[C@H](O)OC=C2C(=O)OC	10-Acetyl genipin	561
C=CC(C)(Cl)C(Cl)CC(Cl)C(C)(C)Cl	3,4,6,7-tetrachloro-3,7-dimethyl-1-octene	731
[H][C@@]12C=C(C=O)CCC=C(COC(C)=O)C[C@H](OC(=O)C(=C)CO)[C@@]1([H])C(=C)C(=O)O2	Vernangulide A	200
NCCCCNC(=O)/C=C/c1ccc(O)cc1	p-Coumaroylputrescine	606
C[C@]1(CC[C@@H](O1)C(C)(C)O)[C@H]2CC[C@@]3([C@@H]2[C@@H](C[C@H]4[C@]3(CC[C@@H]5[C@@]4(CC[C@H](C5(C)C)O)C)C)O)C	Betulafolientriol oxide	981
CC(=O)N1CCCC(=C1)C2=NCCCC2	N-Acetylhystrine	969
C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OC2=C(OC3=CC(=CC(=C3C2=O)O)O)C4=CC(=C(C(=C4)O)O)O)O)O)O	Myricitrin	836
[H][C@@]2(O[C@@H]1O[C@H](C)[C@@H](O)[C@H](OC)[C@H]1O)[C@@H](C)O[C@@H](OC)C[C@@H]2OC	Dresibioside	463
CCC[C@H]1CCCCN1C	Methylconiine	805
CC(C)c2ccc(C)cc2Cc1ccoc1	Tsitsikammafuran	182
O=C2C[C@@H](c1ccccc1O)Oc3cc(O)cc(O)c23	(2S)-5,7,2'-Trihydroxyflavanone	520
CC(C)(O)C[C@@H](O)C1(O)OC[C@]26C(=C\C[C@@H]2[C@H]1C)/[C@@H]7CC[C@H]8Cc9nc%10C[C@]%11(C)[C@H]%12C[C@@H](O)[C@@]5(C)C(=C/[C@@H]4O[C@]3(O[C@](C)(CO)C[C@H]3O)[C@@H](C)[C@@]45O)\[C@@H]%12CC[C@H]%11Cc%10nc9C[C@]8(C)[C@H]7CC6=O	Cephalostatin 9	483
C[C@@H]1C[C@@H]2[C@H]3[C@](CCC[C@@]3([C@]1(CCC4=COC=C4)O)C)(C(=O)O2)C	Marrubiin	291
CC(=C)[C@@H]1CC[C@]2([C@H]1[C@H]3CC[C@@H]4[C@]5(CCC(=O)C([C@@H]5CC[C@]4([C@@]3(CC2)C)C)(C)C)C)CO	Betulone	1108
C1[C@H]([C@H]([C@@H](C[C@@]1(C(=O)O)O)OC(=O)/C=C/C2=CC(=C(C=C2)O)O)O)O	Chlorogenic acid	1090
CN1[C@@H]2CC(C[C@H]1[C@H]3[C@@H]2O3)OC(=O)[C@H](CO)C4=CC=CC=C4	Scopolamine	987
COC1[C@@H]([C@H](C([C@@H]([C@H]1O)O)O)O)O	8-isobutyloxycumambrin-B	963
[H][C@]34CCC(=C)[C@@H](CC[C@]2(O)[C@@H](C)CC[C@]1([H])OC(C)(C)C(=O)CC[C@]12C)[C@]3(C)CC[C@@H](O)C(C)(C)O4	3-epi-Sodwanone K	586
C[C@@]12CCC[C@@]([C@H]1CC[C@]34[C@H]2CC[C@H](C3)C(=C)C4)(C)C(=O)O	Kaurenoic acid	898
C=CC(/C=C\c1ccc(O)cc1)c2cc(O)c(OC)c(OC)c2	Phenol, 5-[(2Z)-1-ethenyl-3-(4-hydroxyphenyl)-2-propenyl]-2,3-dimethoxy- (9CI)	576
Cc2cc(O)c1C(=O)CC[C@@H](O)c1c2	Shinanolone	439
CC=C1C[C@@H](C)[C@](O)(CO)C(=O)OCC2=CCN3(=O)[C@H]2[C@H](OC1=O)CC3	Retrorsine N-oxide	779
[H][C@@]9(O[C@H]8[C@@H](O)CO[C@@]([H])(O[C@H]7C[C@@]6([H])[C@]5([H])CC=C4C[C@@H](O[C@]3([H])O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O[C@]1([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]4(C)[C@@]5([H])CC[C@]6(C)[C@@]7(O)[C@H](C)C(=O)CCC(C)C)[C@@H]8OC(C)=O)OC[C@@H](O)[C@H](O)[C@H]9O	3[beta]-[(O-[beta]-D-glucopyranosyl-(1[to]4)-O-[beta]-D-glucopyranosyl-(1[to]6)-[beta]-D-glucopyranosyl)oxy)]-17[alpha]-hydroxy-16[beta]-[(O-[beta]-D-xylopyranosyl-(1[to]3)-2-O-acetyl-[alpha]-L-arabinopyranosyl)oxy]cholest-5-en-22-one	508
CC(=O)c1ccc(cc1)O	Acetophenone, 4'-hydroxy- (6CI,8CI)	630
C[C@@]34CC[C@H](O)[C@@](C)(C)[C@@H]4/C=C\C(\C)=C3\CC[C@@H]1[C@H](C)CC[C@@H]2O[C@@](C)(C)C(=O)CC[C@@]12C	Sodwanone Q	422
[H][C@]14C[C@@H](OC(C)=O)C=C[C@]15c3cc2OCOc2cc3CN4C[C@@H]5O	3-O-Acetylhamayne	321
C1=C(C=C(C(=C1O)O)O)C(=O)OC[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)OC(=O)C3=CC(=C(C(=C3)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O)OC(=O)C5=CC(=C(C(=C5)O)O)O)O	1,2,3,6-Tetragalloylglucose	944
[H][C@@]4([C@@]3([H])c1cccc(O)c1C(=O)c2c(O)cc(CO)cc23)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O	Aloin A	409
CC(C)(C1CC2=C(O1)C=C3C(=C2O)C(=O)C(=CO3)C4=CC=C(C=C4)O)O	Erythrinin C	856
[H]OC1(C)C(=O)OCC2=CCN3CCC(OC(=O)C(C(C)(C)O)C1(C)O)C23	Globiferine	759
CC1=C(C(=O)C2=C(C1=O)C(=CC(=C2OC)OC)O)CC(=O)C	8-hydroxy-5,6-dimethoxy-2-methyl-3-(2-oxo-propyl)-1,4-naphthoquinone	830
COc3cc(O)c2C(=O)[C@H](Cc1ccc(O)cc1)COc2c3O	8-O-demethyl-7-O-methyl-3,9-dihydropunctatin	360
CC1=CCC2CC1C2(C)C	[alpha]-Pinene	926
[H][C@]35C[C@@H](O)[C@]2(C)[C@@H](c1ccc(=O)oc1)CC[C@]2(O)[C@]3(O)C[C@@H](OC(C)=O)C4=C[C@@H](O)CC[C@@]45C	12[beta]-hydroxyscillirosidin	465
CC(C1(O)CC(C)C(C)(O)C(=O)OCC2=CCN3C2C(OC1=O)CC3)O	Jacoline	769
COC1=CC(=CC2=C1OCO2)CC=C	Myristicin	865
COc1ccc(cc1)CCNCc2ccc(c(c2)OC)OC	N-Demethylbelladine	656
O=c3c2NC=CC1(C=C(Br)C(O)C(Br)=C1)c2c5=NCCc4c[nH]c3c45	7,8-dehydro-3-dihydrodiscorhabdin C	122
C1=CC(=CC=C1C2=COC3=C(C2=O)C=CC(=C3)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O	Daidzin	857
[H][C@@]45CC[C@]3(C)[C@]([H])(CC[C@]2([H])[C@@]1([H])[C@H](C(=C)C)CC[C@]1(CO)CC[C@]23C)[C@@]4(C)CC[C@H](O)C5(C)C	Betulin	516
Oc1ccc5cc1Oc2ccc(cc2)CCc3ccc(O)c(O)c3Oc4cccc(c4)CC5	Marchantin H	772
CC(=O)O[C@H]1C[C@@H]2[C@H](C1=C)[C@@H]3[C@@H](CCC2=C)C(=C)C(=O)O3	Zaluzanin d	1126
O[C@@H]1C[C@@](CC=C2[C@]3([H])CC[C@@]4(C)[C@@]2([H])C[C@@]5([H])[C@]4([H])[C@H](C)[C@]6(OC[C@H](C)CC6)O5)(O)[C@]3(C)C[C@H]1O	7-Dehydroagapanthagenin	747
[H]C(=[C@]=C1C(C)(C)C[C@H](OC(C)=O)C[C@@]1(C)O)/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C(=O)C[C@@]23O[C@]2(C)C[C@@H](O)CC3(C)C	Fucoxanthin	246
COc3ccc(C[C@]2(O)COc1cc(O)cc(O)c1C2=O)cc3	Eucomol	242
[H][C@]24C[C@@H](O)[C@]1(C)[C@@H](C(C)=O)CC[C@]1(O)[C@]2(C)CC=C3C[C@@H](O)CCC34	Digipurpurogenin II	457
CC(=CCCc1ccoc1)CCC=C(C)CCCC(C)C=c2cc(C)c(=O)o2	22-Deoxyvariabilin	736
CN(C)CCc3c2S(=O)c1c(CCN(C)C)c(SC)c(OC)c(OC)c1S(=O)c2c(OC)c(OC)c3SC	Lissocline disulfoxide	450
C=C[C@H]3CCC4C2[C@H](O)C=C1C[C@H](OC(C)=O)CC[C@]1(C)C2[C@H](O)C[C@]34C	Pregna-5,20-diene-3[alpha],7[alpha],11[alpha]-triol 3[alpha]-acetate	170
CC(C)C1=C(C2=C(C(=C1)C=O)[C@]3(CCCC([C@@H]3C=O)(C)C)C(=O)O2)O	Rosmadial	444
C/C(=C\CC(Br)/C(C)=C/C(Cl)Cl)CBr	Plocoralide A	216
[H][C@]12CC[C@](C)(OC(C)=O)C=CCC(=C)[C@]1([H])[C@H](OC(C)=O)OC=C2C(=O)/C=C/C(C)(C)O	Tsitsixenicin C	151
CC2(C)C=Cc1cc5c(cc1O2)OC6Oc4cc3OC(C)(C)C=Cc3c(O)c4C(=O)C56O	Kraussianone 4	347
COc3ccc(c2oc1cc(O)cc(O)c1c(=O)c2O)cc3O	Tamarixetin	335
[H][C@@]23C=C4CC[C@H]1OC1(C[C@H](OC(=O)C(=C)C)C2[C@H](C)C(=O)O3)C(O)OC4	11[beta],13-Dihydrovernolide	298
COc2c(O)ccc(C(=O)/C=C/c1cccc(O)c1)c2O	(E)-3,2',4'-Trihydroxy-3'-methoxychalcone	519
C[C@H]1[C@H]2CC=C3[C@]2(CO[C@]14[C@@H](CC(O4)(C)C)O)C(=O)C[C@H]5[C@H]3CC[C@@H]6[C@@]5([C@H](C7=NC8=C(C[C@]9([C@H](C8)CC[C@@H]1[C@@H]9C[C@H]([C@]2(C1=C[C@H]1[C@@]2([C@@H]([C@@]2(O1)[C@@H](C[C@@](O2)(C)CO)O)C)O)C)O)C)N=C7C6)OC)C	Cephalostatin 19	447
CCCCCCCC/C=C/C[C@H](OC(C)=O)[C@H](C)NC(C)=O	2-acetamido-3-acetoxy-5-tetradecene	143
CC(C)c3c(O)c(O)cc2C(=O)C(O)=C1C(C)(C)CCC[C@]1(C)c23	6,12,13-Trihydroxychina-5,8,11,13-tetraen-7-one	556
C[C@H]1[C@H]2CC=C3[C@]2(CO[C@]14[C@@H]([C@@H](C(O4)(C)C)C)O)C(=O)C[C@]5([C@H]3CC[C@@H]6[C@@]5(CC7=C(C6)N=C8C[C@]9([C@@H](CC[C@@H]1[C@@H]9C[C@H]([C@]2(C1=C[C@H]1[C@@]2([C@@H]([C@@]2(O1)[C@@H](C[C@@](O2)(C)CO)O)C)O)C)O)CC8=N7)C)C)O	Cephalostatin 3	479
COc3ccc(/C=C/2COc1cc(O)cc(O)c1C2=O)cc3	(E)-Eucomin	241
O=C1\C(=C)CCC[C@@]2([C@H]1[C@@H](CC2)C(C)C)C	Millecrone A	190
[H][C@]12[C@@H](COC(=O)\C(=C/C)CO)CCN1CCC2OC(=O)\C(C)=C/C	Sarracin	116
C[C@]12CC[C@@H](C([C@@H]1CC[C@@]3([C@@H]2CC=C4[C@]3(CC[C@@]5([C@H]4CC(CC5)(C)C)C(=O)O)C)C)(C)C)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)C(=O)O)O)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O)O)O	Spinasaponin a	835
[H][C@@]6(O[C@H]4C[C@@]3([H])[C@]2([H])CC=C1C[C@@H](O)CC[C@]1(C)[C@@]2([H])[C@H](O)C[C@]3(C)[C@@]4([H])[C@H](C)[C@@H](O)CCC(C)C)O[C@@H](C)[C@H](O)[C@@H](OC(=O)c5cc(OC)c(OC)c(OC)c5)[C@H]6OC(C)=O	(22S)-cholest-5-ene-3[beta],11[alpha],16[beta],22-tetrol 16-O-{2-O-acetyl-3-O-(3,4,5-trimethoxybenzoyl)-[alpha]-L-rhamnopyranoside}	510
CCCC(=O)C1=C(C=C(C(=C1O)CC=C(C)C)O)O	1-[2,4,6-Trihydroxy-3-(3-methylbut-2-en-1-yl)phenyl]butan-1-one	888
CC(C)C2=C[C@@H]1O[C@]1(C)CCC[C@@H](CO)C(=O)CC[C@@H](C)[C@H](O)C2=O	7,8-Dihydroflabellatene B	578
COc1c2c(cc3c1OCO3)[C@]45C=C[C@@H](C[C@H]4N(C2)C[C@H]5O)OC	Ambelline	653
CC(=CCC1=C(C2=C(C=C1O)O[C@@H](CC2=O)C3=CC=CC=C3)O)C	Isoglabranin	882
[H][C@@]8(O[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@@]1([H])O[C@H]6CC[C@@]2(C)C(=CC[C@]3([H])[C@]2([H])CC[C@@]5(C=O)[C@@]3([H])C[C@]4([H])O[C@@H](O)[C@H](C=C(C)C)[C@@H](C)[C@@]45[H])C6)O[C@@H](C)[C@H](OC(=O)c7ccc(OC)cc7)[C@@H](O)[C@H]8O	Saundersioside F	670
COc1c2ccccc2nc3c1cco3	Dictamnine	628
CN1CC[C@@]23C=C[C@@H](C[C@@H]2Oc4c3c(ccc4OC)C1)O	Galanthamine	637
COc3ccc(C[C@H]2c1cc(O)c(OC)cc1CCN2C)cc3O	Reticuline	385
[H][C@@]34CC[C@]1([H])C(=CC[C@]2(C)[C@@]([H])([C@H](C)N(C)C)[C@H](O)C[C@@]12C)C=C3CC[C@H](N(C)C)C4(C)C	Buxaminol A	599
COC1=CC(=CC(=C1O)OC)C2C3COC(C3CO2)C4=CC(=C(C(=C4)OC)O)OC	Syringaresinol	1042
O=C(/C=C/c1ccccc1)c2ccc(O)cc2O	(E)-2',4'-Dihydroxychalcone	522
[H][C@@]4([C@]3([H])c1cccc(O)c1C(=O)c2c(O)cc(CO)cc23)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O	Aloin B	410
[H][C@@]15C[C@@](C)(O)C(=O)C[C@]1(C)CC[C@]4(C)C3=CC=c2c(C)c(O)c(=O)cc2[C@]3(C)CCC45C	20-hydroxy-20-epi-tingenone	257
COC1=C(OC2=CC(=CC(=C2C1=O)O)O)C3=CC(=C(C=C3)O)O	3-O-Methylquercetin	980
CCCCCCCC/C=C/CC(CNC(C)=O)OC(C)=O	1-Acetamido-2-acetoxy-4E-tridecene	145
COc3ccc(C[C@@H]2COc1cc(O)cc(O)c1C2=O)cc3	3,9-dihydroeucomin	358
C/C=C\1/C[C@H]([C@@](C(=O)OCC2=CCN3[C@H]2[C@@H](CC3)OC1=O)(C)O)C	Senecionine	621
[H][C@@]7(O[C@H]4C[C@@]3([H])[C@]2([H])CC=C1C[C@@H](O)CC[C@]1(C)[C@@]2([H])CC[C@]3(C)[C@@]4(O)[C@H](C)C(=O)CCC(C)C)OC[C@H](O)[C@H](O[C@]5([H])OC[C@@H](O)[C@H](O)[C@H]5OC(=O)/C=C/c6ccccc6)[C@H]7OC(C)=O	3[beta],16[beta],17[alpha]-trihydroxycholest-5-en-22-one 16-0-{0-(2-E-cinnamoyl-[beta]-D-xylopyranosyl)-(1[to]3)-2-O-acetyl-[alpha]-L-arabinopyranoside}	616
CC1=CC2=C(C(=O)C=CC2=O)C(=C1C3=C4C(=O)C=CC(=O)C4=C(C=C3C)O)O	Isodiospyrin	435
C=C[C@](C)(Cl)[C@H](Cl)/C=C/C(=C)C(Cl)Cl	1,3,7-Octatriene, 5,6-dichloro-2-(dichloromethyl)-6-methyl-, [R*,S*-(E)]-(-)- (9CI)	252
CC1(C=CC2=C(O1)C=C3C(=C2O)C(=O)C(=CO3)C4=CC=C(C=C4)O)C	Alpinumisoflavone	938
C/C=C/1\CC(=C)[C@](C(=O)OCC2=CCN3[C@H]2[C@@H](CC3)OC1=O)(C)O	Spartioidine	623
[H][C@]12CCC(C)=CCCC(=C)[C@]1([H])[C@H](OC(C)=O)OC=C2C(C/C=C(C)/C)OC(C)=O	Tsitsixenicin A	149
CC1(C=CC2=C(O1)C=C(C3=C2OC4=C(C3=O)C=CC(=C4O)O)O)C	Isojacareubin	1005
COc2cc(CCc1ccc(O)cc1)cc(OC)c2OC	Phenol, 4-[2-(3,4,5-trimethoxyphenyl)ethyl]-	677
O=C1C(Br)=CC2(C=C1Br)CCNc3c2c5=NCCc4c(Br)[nH]c(c3=O)c45	14-bromo-discorhabdin C	119
C\C3=C\[C@H]1C[C@@H](C)[C@]3(C)CCc2ccoc12	Nakafuran 8	181
CC(=CCC1=C(C(=C2C(=C1O)C(=O)C(=CO2)C3=CC=C(C=C3)O)CC=C(C)C)O)C	6,8-diprenylgenistein	939
C/C(=C\C(Cl)Cl)C(Br)/C=C/C(C)(Cl)CBr	4,8-dibromo-1, 1, 7-trichloro-3, 7-dimethyl-2,5-octadiene	718
[H][C@@]9(O[C@H]8[C@@H](C)CO[C@@]7(O[C@@]6([H])C(=O)[C@@]5([H])[C@]4([H])CC=C3C[C@@H](O)C[C@@H](O[C@]1([H])OC[C@H](O)[C@H](O)[C@H]1O[C@]2([H])O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)[C@]3(C)[C@@]4([H])CC[C@]5(C)[C@@]6([H])[C@@H]7C)[C@H]8O)O[C@H](C)[C@H](O)[C@@H](O)[C@H]9O	Ornithosaponin B	685
CC1=CCC(CC1)(C(C)C)O	Terpinen-4-ol	922
[H][C@]24CCN3CC=C(COC(=O)[C@](C)(O)[C@]1(C)OC(C)(C)[C@@]1([H])C(=O)O2)[C@@]34[H]	Grantaline	760
COc1cc3c(c(OC)c1OC)c(=O)c2ccccc2n3COC(C)=O	Toddaliopsin B	752
C1=CC(=C(C=C1CCC(=O)C2=C(C=C(C(=C2O)[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)O)O)O)O	Aspalathin	1088
O=C(O)/C=C/c1ccc(O)cc1	Trans-3-(4'-hydroxyphenyl)-2-propenoic acid	469
CN1Cc2cc3c(cc2-c4c1cccc4)OCO3	5,6-dihydrobicolorine	634
CN2CCc1c[nH]c(C(=O)O)c1C2=O	Makaluvic acid A	130
C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OC[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC(=C(C=C5)O)O)O)O)O)O)O)O	Rutin	1085
[H][C@@]1([C@@H](C)C[C@@H](C)C[C@@H](C)CCC)C(C)=C(C)C(=O)[C@@]1(C)O	Capensinone	164
C[C@@]12CCCC(C1CCC(=C2C=O)C=O)(C)C	Isopolygodial	649
C/C=C/C1=CC(=C(C=C1)O[C@H](C)[C@@H](C2=CC(=C(C(=C2)OC)OC)OC)O)OC	Surinamensin	860
C[C@@]1(CCC[C@@]2([C@@H]1[C@@H](C[C@]([C@H]2CCC(=C)C=C)(C)O)O)C)CO	Andalusol	935
CC(=O)Oc1cc(C)c(O)cc1C/C=C(C)/CCC/C(C)=C\C(=O)CC(C)C	5,10-Dodecadien-4-one, 12-[2-(acetyloxy)-5-hydroxy-4-methylphenyl]-2,6,10-trimethyl-, (5Z,10E)-	727
C[C@@H]1C[C@@]2([C@@H](C2(C)C)[C@H]3[C@]1([C@@H]4C=C(C(=O)[C@]4(CC(=C3)COC(=O)C)O)C)O)OC(=O)C(C)C	12-deoxyphorbol-13-isobutyrate-20-acetate	281
C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OC2=C(OC3=CC(=CC(=C3C2=O)O)O)C4=CC=C(C=C4)O)O)O)O	Afzelin	846
C=C[C@](C)(Cl)[C@H](Cl)/C=C/C(=C/Cl)C(Cl)Cl	1,3,7-Octatriene, 1,5,6-trichloro-2-(dichloromethyl)-6-methyl-, [R*,S*-(Z,E)]	276
COC1=C(C2=C(C=C1)C(=C3C=COC3=N2)OC)OC	Skimmianine	1045
COC1=CC(=C(C(=C1)O)C(=O)CCC2=CC=C(C=C2)O)O	Asebogenin	1016
C=CC(/C=C\c1ccc(O)cc1)c2ccc(O)cc2	(+)-Nyasol	573
CC1=CC2=C(C=N1)C(=O)C3=C(C2=O)C(=C(C=C3O)OC)O	Bostrycoidin	831
CCC(C)C(=O)C1=C(C=C(C(=C1O)CC=C(C)C)O)O	2-methyl-1-[2,4,6-trihydroxy-3-(3-methylbut-2-en-1-yl)phenyl]butan-1-one	887
C1=CC(=CC=C1/C=C/C(=O)OC[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC=C(C=C5)O)O)O)O)O	Tribuloside 	867
CC[C@H](/C=C/[C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3C2=CC[C@@H]4[C@@]3(CC[C@@H](C4)O)C)C)C(C)C	Spinasterol	1107
[H][C@@]34CC[C@]1([H])C(=CC[C@]2(C)[C@@]([H])([C@H](C)N(C)C)CC[C@@]12C)C=C3CC[C@H](N(C)C)C4(C)C	Buxamine A	602
O=C(O)CN[C@@H]1C4C(=O)C=C2S[C@@H]3C[C@@]12c5c(N3)c(=O)c7[nH]cc6CC[N+]4=c5c67	Discorhabdin N	132
O=C5C([H])=C3[C@@]2(C([H])([H])[H])C([H])([H])c1nc%14c(nc1C([H])([H])[C@]2([H])C([H])([H])C([H])([H])[C@]3(O[H])[C@@]47O[C@]4([H])C([H])([H])[C@]6([H])[C@]([H])(C([H])([H])[H])[C@@]8(OC([H])([H])[C@]567)OC(C([H])([H])[H])(C([H])([H])[H])[C@@]([H])(C([H])([H])[H])[C@]8([H])O[H])C([H])([H])[C@@]%13(C([H])([H])[H])[C@@]([H])(C([H])([H])C([H])([H])[C@@]%12([H])C%11=C([H])[C@@]%10([H])O[C@]9(O[C@](C([H])([H])[H])(C([H])([H])O[H])C([H])([H])[C@]9([H])O[H])[C@@]([H])(C([H])([H])[H])[C@@]%10(O[H])[C@@]%11(C([H])([H])[H])[C@@]([H])(O[H])C([H])([H])[C@]%12%13[H])C%14([H])[H]	Cephalostatin 15	489
CN1[C@H]2C[C@@H](C=C[C@]23c4cc5c(cc4CN([C@@H]3C1=O)CCc6ccc(cc6)O)OCO5)OC	Obliquine	644
[H][C@@]24Cc1cc(O)c(OC)cc1c3c(OC)c(OC)cc(CCN2C)c34	Lauroscholtzine	376
CC(=O)O[C@@H]2C(C(C)C)=CC=C(C)CCC=C(C)CC[C@@H]1O[C@@]1(C)[C@H]2OC(C)=O	Flaccidoxide-13-acetate	535
COC4=C[C@]23CCN(C)[C@H](Cc1ccc(OC)c(O)c12)C3=CC4=O	Salutaridine	379
"CO[C@@H]1C=CC=C(C)Cc2cc(OC)c(c(c2)N(C(=O)C[C@@H]([C@]2([C@H]([C@@H]([C@@H]3C[C@@]1(O)NC(=O)O3)C)O2)C)OC(=O)[C@@H](N(C(=O)C)C)C)C)Cl	"	Maytansine	820
C=C[C@H]3CCC4C2[C@H](OC(C)=O)C=C1C[C@@H](O)CC[C@]1(C)C2CC[C@]34C	Pregna-5,20-diene-3[beta],7[alpha]-diol 7[alpha]-acetate	169
CN(C)CCC1=C2C(=C(C(=C1SC)OC)OC)SSSSS2	N,N-dimethyl-5-(methylthio)varacin	452
C[C@H]1CC[C@]2([C@H](C(=O)CC[C@H]2[C@]1(C)CCC3=COC=C3)C)C	Cascarillone	876
COc3c(O)c(OC)c2oc1cc(O)cc(C)c1c(=O)c2c3O	Drimiopsin A	471
C/C(C)=C/CC/C(C=O)=C/CC/C(C)=C/CC/C(C)=C/Cc1cc(=O)cc(C)c1=O	Sargaquinal	248
CO[C@H]1C[C@H]2[C@]3(C=C1)c4cc5c(cc4C[N@]2C[C@@H]3O)OCO5	Haemanthamine	640
[H][C@@]12CC=C[C@@H](O)[C@]15CC[N@]2Cc4c(OC)c3OCOc3cc45	Buphanamine	338
COc3c(O)cc2oc(c1ccc(O)cc1)c(OC)c(=O)c2c3O	3,6-Dimethoxyapigenin	464
C/C(=C\C=N\OCc1c(F)c(F)c(F)c(F)c1F)/C=C/C(Cl)C(C)(Cl)CBr	2,4-Octadienal, 8-bromo-6,7-dichloro-3,7-dimethyl-, O-[(2,3,4,5,6-pentafluorophenyl)methyl]oxime, (2E,4E)-	210
C[C@]1(CC[C@@]2(CC[C@@]3(C(=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CC[C@@H](C5(C)C)O)C)C)[C@@H]2C1)C)C(=O)O)C(=O)O	Serratagenic acid	1125
C1=CC(=CC=C1C(=O)O)O	4-hydroxybenzoic acid	948
CC2=CC=C(C(C)C)[C@@H](O)C[C@]1(C)O[C@H]1CCC(C)=CCC2	(1Z,3E,7E,11S,12S,14S)-11,12-Epoxy cembra-1,3,7-trien-14-ol	534
[H][C@@]23[C@H](O)[C@@H](OC=O)c1c(c(=O)c(O)c(C(C)C)c1=O)[C@@]2(C)CCCC3(C)C	7[alpha]-Formyloxy-6[beta],12-dihydroxy-abieta-8,12-diene-11,14-dione	365
O[C@H]5C=C[C@@]34CCN(Cc2cc1OCOc1cc23)C4C5	Crinine	311
CN1CCC2=C3C1CC4=CC=CC=C4C3=CC=C2	Aporphine	899
C1=CC(=C(C=C1C2=COC3=CC(=CC(=C3C2=O)O)O)O)O	Orobol	950
[H][C@@]34CC[C@]1([H])C(=CC[C@]2(C)[C@@]([H])([C@H](C)N(C)C)[C@H](O)C[C@@]12C)C=C3CC[C@H](NC)C4(C)C	Buxaminol C	604
C[C@]12C[C@H]3[C@H]([C@@H]([C@H]1C(=C)CC[C@@H]2O)O)C(=C)C(=O)O3	Deacetyl-[beta]-cyclopyrethrosin	432
OCC=C1C[C@@H](C)[C@@](C)(O)C(=O)OCC2=CCN3[C@H]2[C@H](OC1=O)CC3	Eruciflorine	797
CC6=C3c7c(C)cc(O)c8c(O[C@@H]2O[C@H](CO[C@@H]1OC[C@@H](O)[C@H](O)[C@H]1O)[C@@H](O)[C@H](O)[C@H]2O)ccc(OC3(O)c5c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)ccc(O)c5C6=O)c78	1',2-binaphthalen-4-one-2',3-dimethyl-1,8'-epoxy-1,4',5,5',8,8'-hexahydroxy-8-O-[beta]-glucopyranosyl-5'-O-[beta]-xylopyranosyl(1[to]6)-[beta]-glucopyranoside	524
CCCCCCCc1c(O)cc(C/C=C(C)/C)c(O)c1C=O	Flavoglaucin	719
O([C@H]8[C@H](O[C@@H]5C/C4=C/C[C@H]3[C@@H]6C[C@@H]2O[C@@]1(NC[C@@H](C)CC1)[C@@H](C)[C@@H]2[C@@]6(C)CC[C@@H]3[C@@]4(C)CC5)O[C@H](CO)[C@H](O)[C@@H]8O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)[C@@H]9O[C@H]([C@H](O)[C@@H](O)[C@H]9O)C	Solasonine	429
O=C1C([H])([H])[C@]7(O[H])[C@@]([H])(C2=C([H])C([H])([H])[C@@]3([H])[C@]([H])(C([H])([H])[H])[C@]4(OC([H])([H])[C@@]123)OC(C([H])([H])[H])(C([H])([H])[H])C([H])([H])[C@]4([H])O[H])C([H])([H])C([H])([H])[C@@]6([H])C([H])([H])c5nc%13c(nc5C([H])([H])[C@]67C([H])([H])[H])C([H])([H])[C@]%12([H])C([H])([H])C([H])([H])[C@@]%11([H])C%10=C([H])[C@@]9([H])O[C@]8(OC(C([H])([H])[H])(C([H])([H])[H])C([H])([H])[C@]8([H])O[H])[C@@]([H])(C([H])([H])[H])[C@@]9(O[H])[C@@]%10(C([H])([H])[H])[C@@]([H])(O[H])C([H])([H])[C@]%11([H])[C@@]%12(C([H])([H])[H])C%13([H])[H]	Cephalostatin 17	491
[H][C@@]35Cc1ccc(OC)c(O)c1c4c2OCOc2cc(CCN3C)c45	Bulbocapnine	374
[H][C@@]8(O[C@H]5C[C@@]4([H])[C@]3([H])CC=C2C[C@@H](O[C@]1([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)CC[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@]5(O)[C@H](C)C(=O)CCC(C)C)OC[C@H](O)[C@H](O[C@]6([H])OC[C@@H](O)[C@H](O)[C@H]6OC(=O)c7ccc(OC)cc7)[C@H]8OC(C)=O	3[beta],16[beta],17[alpha]-trihydroxycholest-5-en-22-one 3-O-[beta]-D-glucopyranoside 16-O-{O-(2-O-4-methoxybenzoyl-[beta]-D-xylopyranosyl)-(1[to]3)-2-O-acetyl-[alpha]-L-arabinopyrano-side}	617
CC(=C)[C@H]1CC[C@]2([C@H]1CC[C@@]3([C@@H]2CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CC[C@@H](C5(C)C)O)C)C)C)C	Hopenol b	1080
CC1=CC(=O)C(CC1)C(C)C	Piperitone	903
[H][C@@]57CC[C@]1([H])[C@]([H])(CC[C@@]4(C)[C@@]1([H])C[C@]3([H])O[C@]2(CC[C@@H](C)CO2)[C@@H](C)[C@@]34[H])[C@@]5(C)[C@H](O[C@]6([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)C[C@H](O)C7	(25R)-3[beta]-hydroxy-5[alpha]-spirostan-1[beta]-yl [beta]-D-glucopyranoside	407
CC(=CCCc1ccoc1)CCC=C(C)CCCC(C)C=c2cc(CO)c(=O)o2	22-Deoxy-23-hydroxymethylvariabilin	737
O=C4C([H])=C8[C@](O[H])([C@]13O[C@@]1([H])C([H])([H])[C@@]2([H])[C@]([H])(C([H])([H])[H])[C@@]5(OC([H])([H])[C@@]234)OC(C([H])([H])[H])(C([H])([H])[H])C([H])([H])[C@@]5([H])O[H])C([H])([H])C([H])([H])[C@@]7([H])C([H])([H])c6nc9c(nc6C([H])([H])[C@]78C([H])([H])[H])C([H])([H])[C@@]%14([H])[C@@](C9([H])[H])(C([H])([H])[H])[C@@]%13([H])[C@@]([H])(C%12=C([H])[C@]%11([H])O[C@]%10(O[C@@](C([H])([H])[H])(C([H])([H])O[H])C([H])([H])[C@@]%10([H])O[H])[C@@]([H])(C([H])([H])[H])[C@]%11(O[H])[C@]%12(C([H])([H])[H])[C@@]([H])(O[H])C%13([H])[H])C([H])([H])C%14([H])[H]	Cephalostatin 14	488
COC(=O)c1cc(OC)c(O)c(OC)c1	Methyl syringate	605
CC(C)/C=C/C1=C(C2=C(C3=C(CC(CC3=O)O)C=C2C=C1OC)O)O	Deacetylvismione A	958
C[C@]1(/C=C/Cl)C[C@](Cl)(CBr)[C@@H](Cl)C[C@H]1Cl	Violacene	212
COc2cc(O)c1C(=O)[C@]4(COc1c2)Cc3cc(O)c(OC)cc34	(R)-3',5-dihydroxy-4',7-dimethoxyspiro [2H-1-benzopyran- 3(4H),7'-bicyclo[4.2.0]-octa[1,3,5]-trien]-4-one	223
CC1CCC2C1CC(CCC2(C)O)C(=C)C	Pogostol	900
"CN1CCC2=CC(=C(C3=C2[C@@H]1CC4=CC(=C(C=C43)OC)O)OC)O					
"	Boldine	825
O=c4c2NCCC13C=CC(O)C(O)(C1Br)[N+]6=c(c23)c5c(c[nH]c45)CC6	1-Bromo-4-debromo-2-hydroxy-discorhabdin V	126
COc3cc(O)c2c(=O)c1c(O)cc(C)cc1c(=O)c2c3	Physcion	721
CCCCCCCCCCCC(=O)O	Lauric acid	1097
CC1=CC[C@@H]2[C@H]1[C@@H]3[C@@H]([C@H](C[C@@]2(C)O)OC(=O)C)C(=C)C(=O)O3	cumambrin A	962
O=C3\C=C(\C2=C\C(=O)c1c(c(O)cc(c1)C)C2=O)C(=O)c4c3cc(cc4O)C	Mamegakinone	436
O=c5c(O)c(c1ccc(O)c(O)c1)oc6c(O)c(O)cc([C@H]4c2ccc(O)c(O)c2O[C@H](c3ccc(O)c(O)c3)[C@@H]4O)c56	Epimesquitol-(4[beta][to]5)-3,3',4',7,8-pentahydroxyflavonone	559
COc3ccc(/C=C/2COc1c(OC)c(O)cc(O)c1C2=O)cc3	4'-O-methyl-punctatin	243
C[C@]12CCCC([C@@H]1[C@H](C=C([C@@]2(C=O)O)C=O)O)(C)C	Mukaadial	652
[H][C@@]23[C@H](O)[C@@H](OC(C)=O)c1c(c(=O)c(O)c(C(C)C)c1=O)[C@@]2(C)CCCC3(C)C	7[alpha]-Acetoxy-6[beta],12-dihydroxy-abieta-8,12-diene-11,14-dione	364
CC(=CCC/C(=C/CC/C(=C/CC/C=C(/CC/C=C(/CCC=C(C)C)\C)\C)/C)/C)C	Squalene	1105
CC1=C[C@H]2[C@@H](CC[C@]([C@@H]2CC1)(C)O)C(C)C	Cedrelanol	923
[H][C@@]8(O[C@@H]7CO[C@@]([H])(O[C@H]5[C@@H](O)CO[C@@]([H])(O[C@H]4C[C@@]3([H])[C@]2([H])CC=C1C[C@@H](O)CC[C@]1(C)[C@@]2([H])CC[C@]3(C)[C@@]4(O)[C@H](C)C(=O)CCC(C)C)[C@@H]5OC(C)=O)[C@H](OC(=O)c6cc(OC)c(OC)c(OC)c6)[C@H]7O)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]8O	3[beta],17[alpha]-dihydroxy-16[beta]-[(O-[beta]-D-glucopyranosyl-(1[to]4)-O-(2-O-3,4,5-trimethoxybenzoyl-[beta]-D-xylopyranosyl)-(1[to]3)-2-O-acetyl-[alpha]-L-arabinopyranosyl)oxy]cholest-5-en-22-one	501
CC1=CCC2C(C1)CC(CC=C2C)(C)C	Bicyclogermacren	915
[H][C@@]8(O[C@@H]1[C@@H](O)[C@@H](O)CO[C@@]1([H])O[C@@H]7C[C@H](O)CC6=CC[C@]2([H])[C@]([H])(CC[C@@]5(C)[C@@]2([H])C(=O)[C@]4([H])O[C@@]3(OC[C@H](C)[C@H](O)[C@@H]3O)[C@@H](C)[C@@]45[H])[C@]67C)O[C@@H](C)[C@H](O)[C@@H](O)[C@H]8O	Ornithosaponin A	684
CC2(C)[C@@H](Br)C[C@@H](O)[C@@]2(C)[C@]1(O)C[C@H](Br)[C@@](C)(Cl)CC1	1-Deacetoxyalgoane	198
O=C2c1c(O)cc(O)cc1OC[C@H]2Cc3ccc(O)cc3	4'-Demethyl-3,9-dihydroeucomin	357
CN1CCC2OC(=O)C(O)(CC(C(C(=O)OCC(=CC1)C2=O)(C)OC(=O)C)C)C(Cl)C	Doronine	788
C[C@]12CC[C@@H](C[C@@H]1CC[C@@H]3[C@@H]2CC[C@]4([C@@]3(CC[C@@H]4C5=CC(=O)OC5)O)C)O	Uzarigenin	906
[H][C@]12C[C@H](OC)C=C[C@@]14CCN2C(O)c3cc(OC)c(OC)cc34	Papyramine	333
COc2c(O)c(C/C=C(C)\C)c(O)c3C(=O)C[C@H](c1ccccc1)Oc23	Microfolione	531
[H][C@]12C3=CCN1CC[C@H]2OC(=O)/C(=C\C)C[C@@H](C)[C@](O)(CO)C(=O)OC3	Retrorsine	118
"C1C2C(C(C(C(O2)OC(=O)C3=CC(=C(C(=C3)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O)OC(=O)C5=CC(=C(C(=C5)O)O)O)OC(=O)C6=CC(=C(C(=C6C7=C(C(=C(C=C7C(=O)O1)O)O)O)O)O)O
"	Tellimagrandin II	839
COc3ccc(/C=C\2COc1cc(O)cc(O)c1C2=O)cc3	(Z)-Eucomin	527
Cc2ccc([C@@]1(C)CCCC1(C)C)cc2O	(-)-2-Hydroxycuparene	775
OC[C@H]3O[C@@H](Oc2cc(O)cc(/C=C/c1ccc(O)cc1)c2)[C@H](O)[C@@H](O)[C@@H]3O	Resveratrol 3-O-[beta]-D-glucopyranoside	562
[H][C@@]12C=C(CO)CCC=C(C=O)C[C@H](O)[C@@]1([H])C(=C)C(=O)O2	Urospermal A	657
CC1=CCC[C@](C)(O)C=C[C@@H](C(C)C)CCC2=C[C@H](C1)OC2=O	(+)-(1R*,4S*,10R*)-4-Hydroxycembra-2E,7E,11Z-trien-20,10-olide	702
[H]OC(=O)[C@]15CC[C@@H](C)[C@H](C)[C@@]1([H])C4=CC[C@]3([H])[C@@]2(C)CC[C@H](O[H])C(C)(C)[C@]2([H])CC[C@@]3(C)[C@]4(C)CC5	Ursolic acid	744
[H][C@@]9(O[C@H]7[C@@H](O)CO[C@@]([H])(O[C@@H]6C[C@H](O)CC5=CC[C@]1([H])[C@]([H])(CC[C@@]4(C)[C@@]1([H])C[C@]3([H])O[C@]2(CC[C@@H](C)CO2)[C@@H](C)[C@@]34[H])[C@]56C)[C@@H]7O[C@]8([H])O[C@@H](C)[C@H](O)[C@@H](O)[C@H]8O)OC[C@@H](O)[C@H](O)[C@H]9O	(25R)-3[beta]-Hydroxyspirost-5-en-1[beta]-yl O-[alpha]-l-rhamnopyranosyl-(1[to]2)-O-[[beta]-D-xylopyranosyl-(1[to]3)]-[alpha]-L-arabinopyranoside	400
C=C[C@@](C)(Cl)[C@@H](Cl)CC(Cl)C(C)(C)Cl	1-Octene, 3,4,6,7-tetrachloro-3,7-dimethyl-, (3R,4S)	275
C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O[C@H]4[C@@H]([C@H]([C@H]([C@H](O4)COC(=O)C5=CC(=C(C(=C5)O)O)O)O)O)O)O)O	Quercetin 3-O-(6''-galloyl)-beta-D-galactopyranoside	850
[H][C@]3([C@H](C)CC[C@@H](CC)C(C)C)CC[C@@]4([H])[C@]2([H])CCC1=CC(=O)CC[C@]1(C)[C@@]2([H])CC[C@]34C	[beta]-sitostenone	751
C/C/1=C\CC(/C=C/C/C(=C/CC1)/C)(C)C	Humulene	925
CN1CC[C@]2([C@@H]1CC(=O)CC2)C3=CC(=C(C=C3)OC)OC	Mesembrine	1035
COc3ccc(/C=C\c2cc(OC)c1OCOc1c2)cc3O	Combretastatin A-2	676
COc2ccc(/C=C\c1cc(O)c(OC)c(OC)c1)cc2O	Combretastatin A-3	674
C[C@@]34CCC(=O)[C@@](C)(C)[C@@H]4CC(=O)C(\C)=C3\CC[C@@H]1[C@H](C)CC[C@@H]2O[C@@](C)(C)C(=O)CC[C@@]12C	Sodwanone R	421
C1=CC(=CC=C1C2=COC3=CC(=CC(=C3C2=O)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O	Genistin	858
CCC(CCC(C)C1CCC2C3CC=C4CC(CC[C@]4(C)C3CC[C@]12C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C(C)C	3-O-[beta-D-glucopyranosyl]-beta-sitosterol	1129
CC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCc1ccoc1	Furospinosulin 1	738
[H][C@@]35Cc1ccc(cc1)Oc7c(O)c(OC)cc6CCN(C)[C@]([H])(Cc2ccc(OC)c(c2)Oc4cc3c(cc4OC)CCN5C)c67	12-O-Methylcurine	384
C[C@H](CCCC(C)C)[C@H]1CC[C@H]([C@]1(C)CCO)C2=CC(=O)C3=C[C@@H](CC[C@@]3(C2=O)C)O	3[alpha],11-dihydroxy-9,11-seco-cholest-4,7-dien-6,9-dione	233
CC/C=CC/C=CC/C=CCCCCCCCC(=O)O	Alpha linolenic acid	834
[H][C@]13C(=C)C(=O)O[C@]1([H])[C@@]2([H])C(=C)C(=O)OC[C@@]2(C=C)C[C@@H]3OC(=O)C(=C)CO	Vernodalin	299
C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O[C@H]4[C@@H]([C@H]([C@@H](O4)CO)O)O)O)O	Avicularin	1008
c1ccc2c(c1)c(c[nH]2)C(=O)C3=N[C@H](CN3)c4c[nH]c5c4ccc(c5)Br	Spongotine A	414
O=C2c3c(OC(c1ccccc1)C2)cc(O)cc3O	Pinocembrin	105
O=C4CCc1ccc(O)c(c1)Oc2ccc(cc2)C3OC3CO4	Combretastatin D-1	709
C[C@H](CCCC(C)C)[C@H]1CCC2[C@@]1(CCC3[C@@]2(C=C[C@@]4([C@@]3(CC[C@@H](C4)O)C)O)O)C	Cholest-7-en-3,5,7-triol	234
CN1CC[C@H]2OC(=O)[C@]3(O[C@H]3C)CC([C@@](C(=O)OCC(=CC1)C2=O)(C)O)C	Otosenine	781
[H][C@@]7(O[C@@H]5C[C@H](O)CC4=CC[C@]1([H])[C@]([H])(CCC3(C)[C@@]1([H])C[C@H](O[C@]2([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@]3([H])[C@H](C)[C@@H](O)C/C=C(C)/C)[C@]45C)O[C@H](CO[C@@H]6O[C@H](CO)[C@H](O)[C@H](O)[C@H]6O)[C@@H](O)[C@H](O)[C@H]7O	(22S)-1[beta]-[(O-[beta]-D-glucopyranosyl-(1[to]6)-[beta]-D-glucopyranosyl)oxy]-3[beta],22-dihydroxycholesta-5,24-dien-16[beta]-yl [beta]-D-glucopyranoside	395
O=C([C@H](C)C=1OC(\C)=C(\C)C(=O)C=1C)[C@H](C)[C@H](O)[C@H](C)C(=O)O[C@@H]2[C@H](C)C(O)(CC)O[C@H](CC)[C@H]2C	Sisserone A	179
O=C2/C(=C/c1ccc(O)cc1)COc3cc(O)cc(O)c23	(E)-5,7-dihydroxy-3-(4-hydroxybenzylidene)chroman-4-one	612
COc3c(O)cc2OC\C(=C/c1ccc(O)cc1)C(=O)c2c3O	Eucomnalin	244
C[C@@H]1CC[C@@]2([C@H]([C@H]3[C@@H](O2)C[C@@H]4[C@@]3(CC[C@H]5[C@H]4CC=C6[C@@]5(CC[C@@H](C6)O)C)C)C)OC1	Diosgenin	1124
O=C2CCc1ccc(O)c(c1)Oc3ccc(C=CCO2)cc3	Combretastatin D-2	710
COc3ccc(CC2(O)COc1cc(O)cc(O)c1C2=O)cc3O	3,5,7-trihydroxy-3-(3'-hydroxy-4'methoxybenzyl)-4-chromanone	570
CC(=CCCC(=CCCC(C)(C=C)O)C)C	Nerolidol 	913
O=C(O)c2c1C(=O)NCCc1cn2[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O	N-1-[beta]-ribofuranosylmakaluvic acid C	269
O=C2Cc1ccc(Br)cc1N2	6-bromo-2-oxindole	304
CC1CC[C@@H]2CC3=C(C(=O)C[C@]13C2(C)C)C	Cyperotundone	878
CC=C1C[C@@H](C)[C@@](C)(O)C(=O)OCC2=CCN(CC[C@@H](OC1=O)C2=O)C	Senkirkine	774
C/C(=C\Cc1cc(O)c(C)cc1O)CC/C=C(C)/CC(O)CC(C)C	1,4-Benzenediol, 2-[(2E,6E)-9-hydroxy-3,7,11-trimethyl-2,6-dodecadien-1-yl]-5-methyl-	728
C=C(C)C(Br)CC(Br)C(C)=CC(Cl)Cl	4,6-dibromo-1, 1-dichloro-3,7-dimethyl-2,7-octadiene	730
COC1=C(C(=CC=C1)OC)C2=CC(=O)C3=C(O2)C=CC(=C3OC)OC	Zapotin	1031
O=C(O)c1ccc(O)c(O)c1	3,4-dihydroxybenzoic acid	467
[H][C@]23CCC(=C)[C@]1([H])[C@@H](OC(C)=O)OC=C(C(CC(OC(C)=O)C(=C)C)OC(C)=O)[C@@]1([H])CC[C@]2(C)O3	7,8-epoxyzahavin A	157
O[C@@H]1C[C@@](CCC2=C(C[C@@]3([H])[C@]4([H])[C@H](C)[C@]5(OC[C@H](C)CC5)O3)[C@]4(C)CC[C@]62[H])(O)[C@]6(C)C[C@H]1O	8(14)-Dehydroagapanthagenin	748
C1=CC(=C(C=C1/C=C/CC#CC2=CC(=C(C=C2)O[C@@H]3[C@H]([C@@H]([C@H]([C@@H](O3)CO)O)O)O)O)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O	Hypoxoside	1050
CC1=CC(=C(C2=C1C(=O)C=C(O2)CC(=O)C)[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)OC(=O)/C=C/C4=CC=CC=C4)O	Aloeresin F	965
C=CCCCCCC/C=C/CC(CNC(C)=O)OC(C)=O	1-acetamido-2-acetoxy-4,12-tridecadiene	144
CCC[C@H](C)C[C@H](C)C[C@H](C)/C=C(C)\C1=C(C)C(=O)C(C)(O)O1	(Z)-Siphonarienfuranone	163
C/C(=C\Cc1cc(=O)c(C)cc1=O)CC/C=C(C)/CC(=O)CC(C)C	2,5-Cyclohexadiene-1,4-dione, 2-methyl-5-[(2E,6E)-3,7,11-trimethyl-9-oxo-2,6-dodecadien-1-yl]-	716
[H][C@]23CC[C@@]14C=C[C@@](C)(CC[C@@]1([H])[C@]2(C)CC(=O)[C@@H](O)C3(C)C)C4	ent-3[beta]-Hydroxy-beyer-15-ene-2-one	363
COc3ccc(C=C2COc1cc(O)cc(O)c1C2=O)cc3	Eucomin	350
CC(=O)C1=C(C(=C(C=C1O)OC)OC)OC	2-hydroxy-3,4,5,6-tetramethoxy-acetophenone	1052
CC1=CC(=O)C2=C(C=C(C(=C2O1)C)O)O	Isoeugenitol	1060
C[C@@H]1C(=O)C[C@@H]2[C@@]([C@]1(CCC3=COC=C3)O)(CCCC2(C)C)C	Hispanolone	387
C1=CC(=CC=C1C2=CC(=O)C3=C(O2)C(=C(C=C3O)O)C4=C(C=CC(=C4)C5=CC(=O)C6=C(C=C(C=C6O5)O)O)O)O	Amentoflavone	1032
CO[C@@H]1CC=C(C)C[C@H]2C=C(CCC(C(C)C)=CC=C1C)C(=O)O2	(+)-(5R*,10R*)-5-Methoxycembra-1E,3E,7E,11Z,15-pentaen-20,10-olide	541
[H][C@@]23C[C@@H](O)[C@@]5([H])C[C@@H](C)[C@@]([H])(CC=CC=C[C@H](C)C[C@]4([H])C[C@H](O[C@]1([H])O[C@@H](C)[C@@H](O)[C@@H](O)[C@H]1OC)C[C@]([H])(C[C@@H](OC(=O)CCC)[C@](O)(C2)C(=O)O3)O4)O5	Mandelalide B	293
C[C@@H]1CC[C@@]2(CC[C@@]3(C(=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CC[C@@H](C5(C)C)O)C)C)[C@@H]2[C@]1(C)O)C)C(=O)O	Pomolic acid	823
CC1=CC(=O)CC([C@]1(/C=C/[C@@H](C)O)O)(C)C	Vomifoliol	929
[H][C@]3([C@H](C)/C=C/C(CC)C(C)C)CC[C@@]4([H])[C@]2([H])CCC1=CC(=O)CC[C@]1(C)[C@@]2([H])CC[C@]34C	24-Ethylcholesta-4,22-dien-3-one	703
CCCCC/C=C/C=C/C(=O)NCC(C)C	Pellitorine	1082
[H][C@@]47CC[C@]1([H])[C@]([H])(CC[C@@]3(C)[C@@]1([H])C[C@H](O[C@]2([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@]3([H])[C@H](C)[C@@H](O)CCC(C)C)[C@@]4(C)[C@H](O[C@]6([H])O[C@H](COC(=O)c5cc(OC)c(OC)c(OC)c5)[C@@H](O)[C@H](O)[C@H]6O)C[C@H](O)C7	(22S)-16[beta]-[([beta]-D-glucopyranosyl)oxy]-3[beta],22-dihydroxy-5[alpha]-cholestan-1[beta]-yl 6-O-(3,4,5-trimethoxybenzoyl)-[beta]-D-glucopyranoside	404
CC1=CC[C@@H](CC1=O)C(=C)C	(S)-(+)-Carvone 	1055
[H][C@@]23CC=C1C[C@@H](O)CC[C@]1(C)[C@@]2([H])C[C@@H](O)[C@]4(C)[C@H](C(C)=O)CC[C@]34O	Isodigipurpurogenin II	460
[H][C@@]9(O[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@@]1([H])O[C@@H]7CC[C@@]2(C)C(=CC[C@]3([H])[C@]2([H])CCC46[C@@H](OC)O[C@@]5(C)[C@@H](/C=C(C)/C)[C@H](O)O[C@@]([H])(C[C@@]34[H])[C@]56[H])C7)O[C@@H](C)[C@H](OC(=O)c8ccc(OC)cc8)[C@@H](O)[C@H]9O	Saundersioside B	399
Cc3cc4c6cc(C)c(O)c7c(=O)c1c(C[C@H](C)O[C@@H]1C)c(c5c2C[C@H](C)O[C@H](C)c2c(=O)c(c3O)c45)c67	Scutiaquinone A	584
CC1=C([C@]2(CCCC([C@@H]2[C@@H]([C@H]1OC(=O)C)OC(=O)C)(C)C)C)CC/C(=C/CO)/C	6[beta],7[alpha]-Diacetoxylabda-8,13-dien-15-ol	228
CC1=C[C@H]2[C@@H](CCC(=C2CC1)C)C(C)C	(+)-[delta]-Cadinene	918
[H][C@@]8(O[C@H]7CC[C@@]1(C)C(=CC[C@]2([H])[C@]1([H])CC[C@@]6(C)[C@@]2([H])C[C@H](O[C@]5([H])OC[C@H](O)[C@H](O[C@]3([H])OC[C@@H](O)[C@H](O)[C@H]3OC(=O)c4cc(OC)c(OC)c(OC)c4)[C@H]5OC(C)=O)[C@]6(O)[C@H](C)C(=O)CCC(C)C)C7)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]8O	3[beta]-[([beta]-D-glucopyranosyl)oxy)]-17[alpha]-hydroxy-16[beta]-[(O-(2-O-3,4,5-trimethoxybenzoyl-[beta]-D-xylopyranosyl)-(1[to]3)-2-O-acetyl-[alpha]-L-arabinopyranosyl)oxy]cholest-5-en-22-one	502
[H][C@]13CCN2CC=C(COC(=O)[C@](C)(O)[C@](C)(O)[C@@H](C(C)C)C(=O)O1)[C@@]23[H]	Trichodesmine	762
COC1=CC(=CC(=C1OC)OC)C2=C(C(=O)C3=C(C(=C(C(=C3O2)OC)O)OC)O)OC	5,7-Dihydroxy-3,6,8,3',4',5'-hexamethoxyflavone	1091
COc1cc2c(cc1O)CN(C)C[C@H]2c3ccc(O)cc3	Cherylline	334
CC2=C(C)C3(C)CCc1ccoc1C(C2)C3	Nakafuran 9	735
[H][C@]12CC=C(CO)[C@@]1([H])[C@H](O)OC=C2C(=O)OC	Genipin	560
C/C=C/1\[C@@H](C(=CO[C@H]1O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)C(=O)OC)CC(=O)OCCC3=CC(=C(C=C3)O)O	Oleuropein	891
COc3cc(O)c2C(=O)C(Cc1ccc(OC)c(O)c1)COc2c3	5-hydroxy-7-methoxy-3-(3-hydroxy-4-methoxybenzyl)chroman-4-one	615
CC=C1CC(=C)[C@](O)(CO)C(=O)OCC2=CCN3[C@H]2[C@H](OC1=O)CC3	Ridelliine	784
[H][C@@]12CC[C@H](C=C)[C@@]1(C)C[C@@H](O)[C@@]4([H])[C@@]2([H])[C@H](OC(C)=O)C=C3C[C@H](OC(C)=O)CC[C@@]34COC(C)=O	Pregna-5-20-diene-3[alpha], 7[alpha], 11[alpha], 19-tetrol 3[alpha], 7[alpha], 19-triacetate	173
[H][C@]24CC1(C=CC(=O)C=C1)c3c(OC)c(OC)cc(CCN2C)c34	Pronuciferine	378
O[C@@H]1C[C@@](CC[C@]2([H])[C@]3([H])CC[C@@]4(C)[C@@]2([H])C[C@@]5([H])[C@]4([H])[C@H](C)[C@]6(OC[C@H](C)CC6)O5)(O)[C@]3(C)C[C@H]1O	Agapanthagenin	745
CC(=C)[C@@H]1CC[C@]2([C@H]1[C@H]3CC[C@@H]4[C@]5(CC[C@@H](C([C@@H]5CC[C@]4([C@@]3(CC2)C)C)(C)C)OC(=O)C)C)C	Lupeol acetate	1115
C1=CC(=C(C=C1[C@@H]2[C@H](C(=O)C3=C(C=C(C=C3O2)O)O)O)O)O	Taxifolin	954
C[C@H]1CC[C@]2([C@H](C1=C)CC=C3[C@@]2(COC3=O)O)C	Salutarisolide	648
C=C[C@H]3[C@@H](OC(C)=O)CC4C2CCC1CC(=O)C=C[C@]1(C)C2CC[C@]34C	16[beta]-Hydroxy-5[alpha]-pregna-1,20-clien-3-one 16-acetate	147
CC(=O)O[C@@H]1[C@H](OC2=CC(=CC(=C2C1=O)O)O)C3=CC=CC=C3	(2R,3R)-3,5,7-trihydroxy-3-O-acetylflavanone	1017
[H][C@]12CCC(C)=CCCC(=C)[C@]1([H])[C@@H](OC(C)=O)OC=C2C(CC(OC(C)=O)C(=C)C)OC(C)=O	zahavin A	156
CC1=C(C(=O)[C@@H]2[C@@]([C@H]1CCC3=COC=C3)(CCCC2(C)C)C)O	11,12-Dihydro-7-hydroxyhedychenone	931
COc1cc2c(cc1O)C[C@]24COc3cc(O)cc(O)c3C4=O	(R)-3',5,7-trihydroxy-4'-methoxyspiro[2H-1-benzopyran-3 (4H),7'-bicyclo[4.2.0]-octa[1,3,5]-trien]-4-one	222
[H][C@]2([C@H](C)CC[C@H](O)C(C)(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)CC[C@@]3(C)[C@@]4([H])C(=CC[C@]23C)C[C@]56O[C@@H]4C[C@@]5([H])C(C)(C)[C@H](O)C[C@@H]6O	Sutherlandioside A	545
CC(C)(O)CCc4c(O)cc3occ(c2cc1C=CC(C)(C)Oc1cc2O)c(=O)c3c4O	Kraussianone 3	346
[H][C@@]15C[C@@H](C)C(=O)C[C@]1(C)CC[C@]4(C)C3=CC=c2c(C)c(O)c(=O)cc2[C@]3(C)CC[C@]45C	Tingenone	264
C[C@H](CCC=C(C)C)[C@@H]1CC[C@]2([C@]1(CCC3=C2CC[C@@H]4[C@@]3(CC[C@@H](C4(C)C)O)C)C)C	Euphol	1006
C[C@H]1[C@H]2CC=C3[C@]2(CO[C@]14[C@@H](CC(O4)(C)C)O)C(=O)C[C@H]5[C@H]3CC[C@@H]6[C@@]5(CC7=C(C6)N=C8C[C@]9([C@@H](CC[C@@H]1[C@@H]9C[C@H]([C@]2(C1=C[C@H]1[C@@]2([C@@H]([C@@]2(O1)[C@@H](C[C@@](O2)(C)CO)O)C)O)C)O)CC8=N7)C)C	Cephalostatin 1	178
CC1(C=CC2=C(O1)C3=C(C4=C(CC(CC4=O)(C)O)C=C3C=C2OC)O)C	Vismione B	957
[H][C@@]15C[C@@H](C)C(=O)[C@@H](O)[C@]1(C)CC[C@]4(C)C3=CC=c2c(C)c(O)c(=O)cc2[C@]3(C)CC[C@]45C	Tingenine B	265
CC1=CC(=C(C=C1O[C@H]2[C@H]([C@@H]([C@@H](CO2)O)O)O)C/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CCC=C(C)C)O	Nephthoside	226
COc3ccc(C[C@@H]2COc1cc(O)cc(O)c1C2=O)cc3O	5,7-dihydroxy-3-(3'-hydroxy-4'-methoxybenzyl)-4-chromanone	351
[H][C@@]23C[C@@H](O)[C@@H]1O[C@@H]1[C@]24CCN3Cc6c4cc5OCOc5c6OC	Crinamidine	324
C1=CC(=O)OC2=CC(=C(C=C21)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)O	Esculin	892
C1=CC(=C(C=C1/C=C/C(=O)O)O)O	Caffeic acid	984
C=CC(=C)CCC/C(=C/c1cc(C)co1)COC(C)=O	Algoafuran	194
C/C(C)=C\CC/C(=C/CC/C(C)=C/CC/C(C)=C/Cc1cc(=O)cc(C)c1=O)C(=O)O	Sargaquinoic acid	247
[H][C@@]35CC[C@@]2([H])[C@]1(C)CC(=O)/C(=C/C)[C@@]1(C)CC[C@]24C[C@]34CC[C@H](N(C)C)C5(C)C	Cyclobuxophylline K	603
[H][C@@]6(O[C@H]5C[C@@]4([H])[C@]3([H])CC=C2C[C@@H](O)C[C@@H](O[C@]1([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@]2(C)[C@@]3([H])CCC4(C)[C@@]5([H])[C@H](C)[C@@H](O)C/C=C(C)/C)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O	(22S)-1[beta]-[([beta]-D-glucopyranosyl)- oxy]-3[beta],22-dihydroxycholesta-5,24-dien-16[beta]-yl [beta]-D-glucopy- ranoside	394
COc3ccc(C=c1oc(=O)cc1c2ccc(O)c(Br)c2)cc3	3'- bromorubrolide F	309
COc2ccc(/C=C/c1cc(O)cc(O)c1)cc2O	Rhapontigenin	610
[H][C@]5(O[C@H]4CC[C@@]1(C)C(=CC[C@]2([H])[C@]1([H])C[C@@H](OC(=O)/C(C)=C/C)[C@]3(C)[C@@H](C(C)=O)CC[C@]23O)C4)C[C@H](OC)[C@H](O)[C@@H](C)O5	Pregn-5-en-20-one, 3-[(2,6-dideoxy-3-O-methyl-[beta]-D-ribo-hexopyranosyl)oxy]-14-hydroxy-12-[[(2E)-2-methyl-1-oxo-2-buten-1-yl]oxy]-, (3[beta],12[beta],14[beta])-	459
[H][C@@]23CC=C1COC(=O)[C@]1([H])[C@@]2(C)CCCC3(C)C	Drimenin	712
O=c4c2[nH]cc1CC[N+](O)=c(c12)c5c(c3ccc(O)cc3)c[nH]c45	Tsitsikammamine A N-oxime	138
CC1=CC(=CC2=C1OC(C=C2)(C)C)O	Pterochromene L1	1028
[H][C@]45C[C@@]3([H])[C@]2([H])CCC1CC(N)CC[C@]1(C)[C@@]2([H])CC[C@]3(C)[C@@]4([H])[C@@](O)(CCC(C)C(=C)C)C(=O)O5	Clionamine C	289
C1[C@H](N[C@H](C(=O)N1)C2=CNC3=C2C=CC(=C3)Br)C4=CNC5=C4C=CC(=C5)Br	Cis-3,4-dihydrohamacanthin b	416
CC1=C(/C(=C/C(C)CCC/C(=C/CC/C(=C/CCC2=COC=C2)/C)/C)/OC1=O)O	(18R)-Variabilin	180
C/C=C(/C)\C(=O)O[C@H]1C[C@@]2(C(=O)C=C(O2)/C(=C\[C@@H]3[C@@H]1C(=C)C(=O)O3)/CO)C	Centratherin	1075
OC1C(=CC2(C=C1Br)CCNC1=C2C2=NCCc3c2c(C1=O)[nH]c3Br)Br	14-bromo-3-dihydro-discorhabdin C	120
C=C(C)C(C)CCC1(C)C(Cl)C(O)CC3(C)C1CC=C2COC(O)C23	Hamiltonin B	186
CC(=C)[C@@H]1CC[C@]2([C@H]1[C@H]3CC[C@@H]4[C@]5(CCC(=O)C([C@@H]5CC[C@]4([C@@]3(CC2)C)C)(C)C)C)C(=O)O	Betulonic acid	1106
[H][C@@]12C=C(CO)CCC=C(C=O)CC[C@@]1([H])C(=C)C(=O)O2	Cyclodeca[b]furan-6-carboxaldehyde, 2,3,3a,4,5,8,9,11a-octahydro-10-(hydroxymethyl)-3-methylene-2-oxo-, [3aS-(3aR*,6E,10Z,11aS*)]- (9CI)	662
CC1=CC(=O)OC2=C1C(=CC(=C2)OC)OC	5,7-Dimethoxy-4-methylcoumarin	1020
CC(C)C1=C(C(=C2C(=C1)[C@@H]3C[C@@H]4[C@@]2(CCCC4(C)C)C(=O)O3)O)O	Carnosol	443
O=c5c(O)c(c1ccc(O)c(O)c1)oc6c(O)c(O)cc([C@@H]4c2ccc(O)c(O)c2O[C@H](c3ccc(O)c(O)c3)[C@H]4O)c56	Mesquitol-(4[alpha][to]5)-3,3',4',7,8-pentahydroxyflavonone	558
COCn1c2cc(OC)c(c(c2c(=O)c2c1cccc2)OC)OC	Toddaliopsin D	754
COc3c(O)c(C/C=C(C)\C)c2O[C@H](c1ccccc1)CC(=O)c2c3O	Agrandol	696
CC1=C2[C@@H]3[C@]4(O3)CC[C@H]5[C@]([C@@H]4[C@@H]6[C@]2(O6)OC1=O)(CCCC5(C)C)C	Jolkinolide b	873
C1=CC(=C(C=C1C[C@H](C(=O)O)OC(=O)/C=C/C2=CC(=C(C=C2)O)O)O)O	Rosmarinic acid	853
COc3cc2nc1occc1c(OC)c2cc3OCC4OC4(C)C	Tecleanatalensine A	626
C/C/1=C\CC/C(=C/[C@H]2[C@H](C2(C)C)CC1)/C	Bicyclo[8.1.0]undeca-2,6-diene, 3,7,11,11-tetramethyl	633
CCCCCCCCC=CCCCCCCC(=O)O	8-Heptadecenoic acid	897
CC(C)=CC(=O)OC2CC1C(C)=CC(=O)C(C(C)C)C1C=C(C)C3(O)C=CC2(C)O3	Valdivone A	733
CC1(C(O1)CC2=C(C=C3C(=C2OC)C=CC(=O)O3)OC)C	Aculeatin	1019
O=c2c(N/C=C/c1ccc(O)cc1)cc4=NCCc3c[nH]c2c34	Makaluvamine M	240
[H][C@@]23CC(=O)c1cc(O)c(O)c(C(C)C)c1[C@@]2(C)CCCC3(C)C	12,13-Dihydroxychina-8,11,13-trien-7-one	555
C=C(C)C(C)CCC2(C)C(Cl)C(O)CC1(C)C(C=O)C(C=O)=CCC12	Hamiltonin C	187
CC(=CCC1=C(C=C2C(=C1OC)C=CC(=O)O2)OC)C	Toddaculin	1018
C[C@]12CCC[C@]3(C1[C@@H](C[C@]([C@@]3(CCC4=COC=C4)O)(C)O)OC2=O)C	Leonotin	933
"C[C@@]12CC[C@@H]3[C@H](CC3(C)C)C(=C)CC[C@H]1O2
"	Caryophyllene oxide	909
C/C=C/C1=CC(=C(C(=C1)OC)OC)OC	Isoelemicin	864
[H][C@@]8(O[C@H]7CC[C@@]1(C)C(=CC[C@]2([H])[C@]1([H])CC[C@@]6(C)[C@@]2([H])C[C@H](O[C@]5([H])OC[C@H](O)[C@H](O[C@]3([H])OC[C@@H](O)[C@H](O)[C@H]3OC(=O)c4ccc(OC)c(OC)c4)[C@H]5OC(C)=O)[C@]6(O)[C@H](C)C(=O)CCC(C)C)C7)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]8O	3[beta]-[([beta]-D-glucopyranosyl)oxy]-17[alpha]-hydroxy-16[beta]-[(O-(2-O-3,4-dimethoxybenzoyl-[beta]-D-xylopyranosyl)-(1[to]2)-2-O-acetyl-[alpha]-L-arabinopyranosyl)oxy]cholest-5-en-22-one	496
[H][C@@]7(O[C@H]6CC[C@@]1(C)C(=CCC2[C@]1([H])CCC35[C@H](OC)O[C@@]4(C)[C@@H](/C=C(C)/C)C(O)O[C@@]([H])(C[C@@]23[H])[C@]45[H])C6)O[C@H](CO)C(O)[C@H](O)[C@H]7OC8OC(CO)[C@@H](O)C(O)[C@H]8OC9OC(C)[C@H](O)C(O)C9O	Saundersioside A	493
C[C@@]1(C=CCl)C[C@@](Br)(CBr)[C@H](Cl)C[C@@H]1Cl	5-bromo-5-bromomethyl-1-chlorovinyl-2,4-dichloro-methylcyclohexane	732
[H][C@@]12C=C(C)[C@@H](OC(C)=O)CC=C(C)C[C@@H](OC(=O)/C(=C/CO)CO)[C@@]1([H])C(=C)C(=O)O2	Eucannabinolide	430
CC1=CC2=C(C=CC(=C2C=C1)C)C(C)C	Cadalene	880
C[C@@H]1CC[C@H]2[C@H](C(=O)O[C@H]3[C@@]24[C@H]1CC[C@](O3)(OO4)C)C	Artemisinin	1062
[H][C@]12C(=C)CCN1(=O)CC[C@@H]2OC(=O)/C(C)=C\C	7[alpha]-angelyl-1-methylene-8[alpha]-pyrrolizidine-4-oxide	114
C1=CC(=CC=C1O)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O	Arbutin	845
[H][C@@]%10(O[C@H]8[C@@H](O)CO[C@@]([H])(O[C@H]7C[C@@]6([H])[C@]5([H])CC=C4C[C@@H](O[C@]3([H])O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O[C@]1([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]4(C)[C@@]5([H])CC[C@]6(C)[C@@]7(O)[C@H](C)C(=O)CCC(C)C)[C@@H]8OC(C)=O)OC[C@@H](O)[C@H](OC(=O)c9ccc(OC)c(OC)c9)[C@H]%10O	3[beta]-[(O-[beta]-D-glucopyranosyl-(1[to]4)-O-[beta]-D-glucopyranosyl-(1[to]6)-[beta]-D-glucopyranosyl)oxy)]-17[alpha]-hydroxy-16[beta]-[(O-(3-O-3,4-dimethoxybenzoyl-[beta]-D-xylopyranosyl)-(1[to]3)-2-O-acetyl-[alpha]-L-arabinopyranosyl)oxy]cholest-5...	507
CC=C1CC(=C)[C@](C)(OC(=O)C)C(=O)OCC2=CCN3[C@H]2[C@H](OC1=O)CC3	Acetylspartioidine	799
O=c3c2NCCC1(C=C(Br)C(O)C(Br)=C1)c2c5=NCCc4c[nH]c3c45	3-dihydro-discorhabdin C	121
C/C=C/1\C[C@H]([C@@](C(=O)OCC2=CCN3C2[C@@H]([C@@H](C3)OC1=O)O)(C)O)C	Madurensine	999
[H][C@@]45CC[C@@]3(C)C2=CC[C@@]1(C(=O)O)CCC(C)(C)C[C@@]1([H])[C@]2(C)CC[C@]3([H])[C@@]4(C)CC[C@H](OC(C)=O)C5(C)C	D-Friedoolean-14-en-oic acid	174
CC(Cl)(/C=C/[C@H](Br)[C@](C)(Cl)/C=C/Cl)CBr	1,5-Octadiene, 4,8-dibromo-1,3,7-trichloro-3,7-dimethyl-, (1E,3R,4S,5E)-rel-	215
CC2(C)[C@@H](Br)C[C@@H](O)[C@@]2(C)[C@]1(O)C[C@H](Br)[C@@](C)(Cl)C[C@@H]1OC(C)=O	Algoane	196
[H][C@]23CC[C@@]14C=C[C@@](C)(CC[C@@]1([H])[C@]2(C)CC(=O)[C@@H](O)[C@]3(C)CO)C4	ent-3[beta],18-Dihydroxy-beyer-15-ene-2-one	663
C1=CC(=CC=C1C2=COC3=C(C2=O)C=CC(=C3)O)O	Daidzein	859
COc2cc(CCc1ccc(O)c(O)c1)cc(OC)c2	Combretastatin B-4	679
C1C[C@H]2C(=O)N[C@H](C(=O)N2C1)CC3=CC=C(C=C3)O	Pyrrolo[1,2-a]pyrazine-1,4-dione, hexahydro-3-[(4-hydroxyphenyl)methyl]-, (3S,8aS)	428
[H][C@@]46CC[C@]1([H])[C@]([H])(CC[C@@]3(C)[C@@]1([H])C[C@H](O[C@]2([H])O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)[C@]3([H])[C@H](C)[C@@H](O)CC=C(C)C)[C@@]4(C)[C@H](O[C@]5([H])O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)C[C@H](O)C6	(22S)-16[beta]-[([alpha]-L-rhamnopyranosyl)oxy]-3[beta],22-dihydroxycholest-24-en-1[beta]-yl [alpha]-L-rhamnopyranoside	668
Cc3ccc2Cc1occc1CCc2c3C	5, 10-Dihydro-6, 7-dimethyl-4H-benzo [5, 6] cyclohepta [1, 2-b]-furan	713
CC=C1CC(=C)[C@](O)(CO)C(=O)OCC2=CCN3(=O)[C@H]2[C@H](OC1=O)CC3	Riddelline N-oxide	790
[H][C@@]45C[C@H](O)[C@@]1([H])[C@]2(C)CO[C@]1(C=C[C@@H]2NC(=O)c3ccccc3)CC4=CC[C@@]6(C)[C@@]5(C)C[C@@H](O)[C@]6([H])[C@H](C)N(C)C	O10-Natafuranamine	597
C/C=C/1\C[C@H]([C@@](C(=O)OC[C@H]2[C@@H](CN3[C@H]2[C@@H](CC3)OC1=O)O)(C)O)C	Rosmarinine	624
CC(=O)O[C@@H]2C(C(C)C)=CC=C(C)CCC=C(C)CC[C@@H]1O[C@@]1(C)[C@H]2O	flaccidoxide	533
O=C1OC2CCN3(=O)C2C(=CC3)COC(=O)C(C(C(C1=C)C)C)(C)O	Senecivernine N-oxide	792
O[C@H]1C(=C)\CCC[C@]2(CC[C@H]([C@@H]12)C(C)C)C	Millecrol A	192
C=CCC/C=C\C#CCCCCCCCCCN(C)CCNC	Clathculin A	543
COc2c(O)cc(O)c3C(=O)C(=Cc1ccc(O)cc1)COc23	5,7-dihydroxy-8-methoxy-3-(4'-hydroxybenzylidene)-4-chromanone	253
COC1=C(C=C(C=C1)C23CCNC2CC45C(=C3)C6CC(O4)(CC7C6(CCN57)C8=CC(=C(C=C8)OC)OC)O)OC	Channaine	1054
COc2cc(CCc1ccc(O)c(O)c1)cc(OC)c2OC	Combretastatin B-3	680
[H][C@]45CC[C@H](C)[C@](C)(CC[C@]2(C)[C@@H](C)CC[C@]1([H])OC(C)(C)[C@@]3(O)CC[C@]12O3)C4=CC[C@H](O)C(C)(C)O5	Sodwanone V	592
C1=CC(=C(C=C1C2=CC(=O)C3=C(O2)C=C(C=C3O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)O)O	Luteolin-5-O-glucoside	1061
COC1=CC=C(C=C1)/C=C/CO	4-methoxycinnamyl alcohol	1100
CCC=CCC=CCCCC=CC=C[C@H](N)C	(3E,5E,10Z,13Z)-hexadeca-3,5,10,13-tetraene-2-amine	765
COc1cc(C(=O)O)ccc1O	4-hydroxy-3-methoxybenzoic acid	468
COc3cc(C[C@@H]2COc1cc(O)cc(O)c1C2=O)ccc3O	5,7-dihydroxy-(4'-hydroxy-3'-methoxybenzyl)-4-chromanone	513
[H][C@]12C[C@]([H])(O[C@H](CC)[C@@H](Br)C[C@@H]1Br)[C@H](C/C=C\C#C)O2	(3Z)-Bromofucin	705
[H][C@]35CC(=O)[C@]2(C)[C@@H](c1ccc(=O)oc1)CC[C@]2(O)[C@]3(O)C[C@@H](OC(C)=O)C4=C[C@@H](O)CC[C@@]45C	6[beta]-acetoxy-3[beta],8[beta],14[beta]-trihydroxy-12-oxobufa-4,20,22-trienolide	466
[H][C@]46Cc1ccc(cc1)Oc8c(O)c(OC)cc7CCN(C)[C@]([H])(Cc3ccc2Oc5c(OCc2c3)c(OC)cc(CCN4C)c56)c78	Insulanoline	386
COc2c(O)cc(O)c3C(=O)/C(=C/c1ccc(O)cc1)COc23	Punctatin	523
O=C2c1c(O)cc(O)cc1OC[C@]25Cc4cc3OCOc3cc45	(R)-Scillascillin	221
C=C(CC1=CC=C(C=C1)O)C(=C)CC2=CC=C(C=C2)O	Anolignan B	993
C(CC(=O)O)C(=O)O	Succinic acid	1023
CCC[C@H](C)C[C@H](C)C[C@H](C)/C=C(C)/C1=C(C)C(=O)C(C)(O)O1	(E)-Siphonarienfuranone	162
CC(=C)C1([C@@H]2[C@H]([C@]3([C@@]4(CO4)[C@H]5[C@@H]([C@]3([C@H]1C(=O)O2)O)O5)C)O)O	Hyenanchin	1114
CC(C)[C@H]2CC[C@H](C)C13C(=O)\C=C(\C)[C@H]1[C@H]23	Cubebenone	195
COCc3cc2c(C)c(O)c1CCC(=O)c1c2[nH]3	Dilemmaone C	267
[H][C@]45C[C@]1([H])C(=CC[C@@]2(C)[C@@]1(C)C[C@@H](OC(C)=O)[C@]2([H])[C@H](C)N(C)C)C[C@]6(O)C=C[C@H](NC(=O)c3ccccc3)[C@](C)(CO4)[C@]56[H]	Buxafuranamide	600
CC1=CC(=C(C2=C1C(=O)C=C(O2)CC(=O)C)[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)OC(=O)/C=C/C4=CC=C(C=C4)O)OC	7-O-Methylaloeresin A	893
Oc3cc(CC(OC(C)=O)C(O)(COC(C)=O)[C@@]21CC[C@](C)(C[C@H](O1)\C=C(/C)CC\C=C(/C)C)O2)c(O)cc3C	Sindurol	227
COCc3cc2c(C)cc1CCC(=O)c1c2[nH]3	Dilemmaone A	262
Cn3cc4CC[N+](O)=c5c2c(c1ccc(O)cc1)c[nH]c2c(=O)c3c45	Tsitsikammamine B N-oxime	139
CC(C1(O)CC(C)C(C)(O)C(=O)OCC2=CCN3C2C(OC1=O)CC3)Cl	Jaconine	767
CCCCC/C=C\C/C=C\CCCCCCCC(=O)O	Linoleic acid	1098
[H][C@@]9(O[C@H]7[C@@H](O)CO[C@@]([H])(O[C@@H]6C[C@H](O)CC5=CC[C@]1([H])[C@]([H])(CC[C@@]4(C)[C@@]1([H])C[C@]3([H])O[C@]2(C[C@H](O)[C@@H](C)CO2)[C@@H](C)[C@@]34[H])[C@]56C)[C@@H]7O[C@]8([H])O[C@@H](C)[C@H](O)[C@@H](O)[C@H]8O)OC[C@@H](O)[C@H](O)[C@H]9O	(24S,25S)-3[beta],24-dihydroxyspirost-5-en-1[beta]-yl O-[alpha]-L-rhamnopyranosyl-(1[to]2)-O-[[beta]-D-xylopyranosyl-(1[to]3)]-[alpha]-L-arabinopyranoside	401
[H][C@]14C[C@@H](O)C=C[C@]15c3cc2OCOc2cc3CN4C[C@@H]5O	Hamayne	322
Cl/C(=C)/C=C/[C@H](O)C/C(=C)C[C@H]3OC4[C@@H](O)[C@@]7(O)O[C@@H](CCC\C=C/[C@H]6O[C@]1(OC(C[C@@H](OC)C1)CC(=O)[C@@H](C)[C@H](O)[C@H](\C(=C)C[C@H]5O[C@]2(OC(C[C@@H](OC(=O)C)C2)CC(=O)O[C@@H]([C@@H]3O)[C@H]4C)C[C@@](O)(C)C5)C)C[C@H](O)C6)[C@@H](C)[C@H](O)C7	Spongiostatin 4	177
CC(=C)[C@@H]1[C@@H]2[C@H]([C@]3([C@@]4(CO4)[C@H]5[C@@H]([C@]3([C@H]1C(=O)O2)O)O5)C)O	Tutin	1113
COc2ccc(/C=C\c1cc(OC)c(OC)c(OC)c1)cc2O	Combretastatin A-4	681
COC(=O)C[C@@H]1[C@](C)([C@@H](OC(=O)C)C[C@@H](C1(C)C)OC(=O)C)[C@H]1[C@@H](OC(=O)C)[C@H](OC(=O)C)[C@@]2(C(=CC[C@@H]2c2ccoc2)C1=C)C	Turraflorin I	814
O=C2c1c(O)cc(O)cc1OC[C@@]2(O)Cc3ccc(O)cc3	4'-O-demethyleucomol	361
[H][C@]67C[C@@]5([H])[C@]4([H])CC=C3C[C@@H](O[C@]1([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O[C@]2([H])O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)CC[C@]3(C)[C@@]4([H])CC[C@]5(C=O)[C@@]6([H])[C@H](C)[C@@H](/C=C(C)/C)[C@H](O)O7	Saundersioside D	398
C/C(=C\C[C@H]1C(=C)CC[C@@H]2[C@@]1(C[C@H](C[C@@]2(C)C(=O)O)O)C)/C=C	1-Naphthalenecarboxylic acid, decahydro-3-hydroxy-1,4a-dimethyl-6-methylene-5-[(2E)-3-methyl-2,4-pentadien-1-yl]-, (1R,3R,4aR,5S,8aR)	442
[H][C@]78C[C@@]6([H])[C@]5([H])CC=C4C[C@@H](O[C@]1([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O[C@]2([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[C@]3([H])O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)CC[C@]4(C)[C@@]5([H])CC[C@]6(C=O)[C@@]7([H])[C@H](C)[C@@H](/C=C(C)/C)[C@H](O)O8	Saundersioside C	397
C[C@@]12CC[C@@]3(C(=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CC[C@@H](C5(C)C)O)C)C)[C@@H]1CC(CC2)(C)C)C	[beta]-amyrin	1037
CC1=C(O)C(=O)C(C(C)C)CC1	Diosphenol 2	176
CC(=CCOc1cc2c(cc1OC)nc3c(c2OC)cco3)C	Tecleanatalensine B	627
COc3cc(O)c2C(=O)C(O)(Cc1ccc(O)c(OC)c1)COc2c3	3,5-dihydroxy-7-methoxy-3-(4'-hydroxy-3'-methoxybenzyl)chroman-4-one	477
[H][C@]12C[C@@H](O)C=C[C@@]15CCN2Cc4cc3OCOc3cc45	Epivittatine	319
CC(=O)N1CCCC(=C1)[C@H]2CCCCN2C	N'-Methylammodendrine	972
CC(C)c4cc3=CC=C2C(C)(C)C[C@H](OC(=O)c1ccc(O)cc1)C[C@]2(C)c3c(O)c4=O	Parviflorone D	367
[H][C@@]5(O[C@H]4C[C@@]3([H])[C@]2([H])CC=C1C[C@@H](O)CC[C@]1(C)[C@@]2([H])[C@H](O)C[C@]3(C)[C@@]4([H])[C@H](C)[C@@H](O)C/C=C(C)/C)O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O	(22S)-Cholesta-5,24-diene-3[beta],11[beta],16[beta],22-tetrol 16-O-[alpha]-L-rhamnopyranoside	695
COc3ccc(C[C@]2(O)COc1cc(OC)cc(O)c1C2=O)cc3	7-O-Methyleucomol	323
CC(=CCC1=C(C(C(=O)C(=C1O)C(=O)CCC2=CC=CC=C2)(CC=C(C)C)OC)O)C	Helihumulone	1057
COc3ccc(CC2(O)COc1c(OC)c(OC)cc(O)c1C2=O)cc3O	3,5-dihydroxy-7,8-dimethoxy-3-(3'-hydroxy-4'-methoxybenzyl)-4-chromanone	568
C[C@@H]3CC[C@H](OC(=O)c1ccoc1)[C@@]4(C)[C@@H](OC(=O)c2ccoc2)C[C@H]5C[C@]34OC5(C)C	1[alpha],9[beta]-Difuranoyloxydihydro-[beta]-agarofuran	552
CCCCCCCCC(=O)O	Nonanoic acid	895
O=C7[C@@]31/C(=C/C[C@@H]3[C@H](C)[C@]2(OC1)OC(C[C@H]2O)(C)C)[C@@H]6CC[C@H]5Cc4nc%12c(nc4C[C@]5(C)[C@@]6(O)C7)C[C@@H]%13CC[C@H]%11/C%10=C/[C@@H]9O[C@]8(O[C@](C)(CO)C[C@H]8O)[C@@H](C)[C@]9(O)[C@@]%10(C)[C@H](O)C[C@@H]%11[C@@]%13(C)C%12	Cephalostatin 2	478
C/C(=C\[C@H](C(C)C)N([CH3])C(=O)[C@@H](NC(=O)[C@@H](N[CH3])C(C)(C)c1cn([CH3])c2ccccc12)C(C)(C)C)C(=O)O	Hemiasterlin	706
CC=C1CC(=C)[C@@](C)(OC(=O)C)C(=O)OCC2=CCN3(=O)[C@H]2[C@H](OC1=O)CC3	Acetylseneciphylline N-oxide	795
C[C@H]1[C@H]2CC=C3[C@]2(CO[C@]14[C@@H](CC(O4)(C)C)O)C(=O)C[C@H]5[C@H]3CC[C@@H]6[C@@]5(CC7=C(C6)N=C8[C@@H]([C@]9([C@@H](CC[C@@H]1[C@@H]9C[C@H]([C@]2(C1=C[C@H]1[C@@]2([C@@H]([C@@]2(O1)[C@@H](C[C@@](O2)(C)CO)O)C)O)C)O)CC8=N7)C)OC)C	Cephalostatin 18	446
C[C@]12CC[C@@H](C([C@@H]1CC[C@@]3([C@@H]2CC=C4[C@]3(CC[C@@]5([C@H]4CC(CC5)(C)C)C(=O)O)C)C)(C)C)O	Oleonolic acid	983
CC1=CC=C(C(C)C)C(=O)[C@@H](O)[C@H](C)CCC(=O)[C@H](CO)CCC1	7,8-Dihydroflabellatene A	577
[H][C@@]8(O[C@H]5C[C@@]4([H])[C@]3([H])CC=C2C[C@@H](O[C@]1([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)CC[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@]5(O)[C@H](C)C(=O)CCC(C)C)OC[C@H](O)[C@H](O[C@]6([H])OC[C@@H](O)[C@H](O)[C@H]6OC(=O)/C=C/c7ccccc7)[C@H]8OC(C)=O	3[beta],16[beta],17[alpha]-trihydroxycholest-5-en-22-one 3-O-[beta]-D-glucopyranoside 16-O-{O-(2-E-cinnamoyl-[beta]-D-xyopyranosyl)-(1[to]3)-2-O-acetyl-[alpha]-L-arabinopyranoside}	618
COc2c(O)cc(C)c3c1cccc(O)c1c(=O)oc23	Autumnariniol	229
CC1=C(C(C[C@@H](C1)O)(C)C)/C=C/C(=C/C=C/C(=C/C=C/C=C(C)/C=C/C=C(C)/C=C/[C@H]2C(=C[C@@H](CC2(C)C)O)C)/C)/C	Lutein	851
C[C@]45CCC(=O)[C@](C)(C)O[C@H]5CCC(\C)=C4\CC[C@]3(C)[C@@H](C)CC[C@@H]2OC1(O)CCC23O[C@@]1(C)C	Sodwanone O	419
[H][C@@]56CC[C@]1([H])C(CC[C@@]4(C)[C@@]1([H])C[C@]3([H])OC(=O)[C@]2(CCC(=O)O2)[C@@]34[H])[C@@]5(C)CC[C@H](N)C6	Clionamine D	290
[H][C@]46Cc1ccc(cc1)Oc8c(OC)c(OC)cc7CCN(C)[C@]([H])(Cc3ccc2Oc5c(OCc2c3)c(OC)cc(CCN4C)c56)c78	Insularine	383
C/C=C\1/CC(=C)[C@@](C(=O)OCC2=CCN3[C@H]2[C@@H](CC3)OC1=O)(C)OC(=O)C	Acetylseneciphylline	625
COC(=O)C[C@@H]1[C@](C)(C=CC(=O)C1(C)C)[C@H]1[C@@H](OC(=O)C)[C@H](OC(=O)C)[C@@]2(C(=CC[C@@H]2C2=CC(OC2=O)O)C1=C)C	Turraflorin D	809
COc3c(O)c2c(=O)c1c(C)cc(O)cc1oc2c(OC)c3OC	Drimiopsin B	472
CC1=CCC=C(C)C[C@H]2C=C(CC[C@H](C(C)C)C=C1)C(=O)O2	(+)-(1R*,10R*)-Cembra-2E,4E,7E,11Z-tetraen-20,10-olide	701
CCCCCCCCCCCCCC(=O)O[C@H]1CC[C@@H](C(=O)NC1)NC(=O)[C@@H]([C@@H]([C@H]([C@@H](/C=C/C(C)C)O)O)O)OC	Bengamide A	423
COc2cc(CCc1ccc(OC)c(O)c1)cc(OC)c2	Phenol, 5-[2-(3,5-dimethoxyphenyl)ethyl]-2-methoxy-	678
C/C/1=C\[C@H](C2[C@H](CC(=C)[C@H](CC1)O)OC(=O)C2=C)O	Tanachin	994
CC[C@H](/C=C/[C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)O)C)C)C(C)C	Stigmasterol	1007
O=c2cc4NCCc3cn(C1O[C@H](CO)[C@@H](O)[C@H]1O)c(c2=O)c34	N-1-[beta]-D-ribofuranosyldamirone C	249
C[C@@H](CCC[C@@H](C)CCC/C(=C/CO)/C)CCCC(C)C	Phytol	1027
CC2=CCc1c(C)coc1CC(C)=CCC2	Isofuranodiene	739
C[C@@H]6[C@@]1(O[C@](C)(CO)C[C@H]1O)O[C@H]7/C=C5/[C@@H]8CC[C@H]9Cc%10nc%11C[C@]%12(C)c%13cc4OC2(O[C@](C)(C)[C@@H](C)[C@H]2O)[C@@H](C)[C@H]3C[C@@H](O)c(c34)c%13CC[C@H]%12Cc%11nc%10C[C@]9(C)[C@H]8C[C@@H](O)[C@]5(C)[C@@]67O	Cephalostatin 5	448
[H][C@]13CC=CC(=O)[C@]1(C)C=c2oc(=O)c(C)c2C3	4a[alpha]H-3,5[alpha],8[beta]a- trimethyl-4,4a,8a-trihydronaphtho-([2,3b]-dihydrofuran-2- one)-8-one	354
CC=C1C[C@@H](C)[C@@](C)(O)C(=O)OCC2=CCN3(=O)[C@H]2[C@H](OC1=O)CC3	Senecionine N-oxide	778
[H][C@]12C(=C)C(=O)OC[C@@]1(C=C)C[C@H](OC(=O)C(=C)CO)[C@@H](C(=C)C(=O)OC)[C@@H]2O	Vernodalol	341
Oc3cc(O)c2C[C@H](O)[C@@H](c1ccc(O)c(O)c1)Oc2c3	Catechin	286
CC[C@H](CC[C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)O)C)C)C(C)C	Beta-Sitosterol	102
C/C(=C\C[C@H]1C(=C)CC[C@@H]2[C@@]1(C[C@H](C[C@@]2(C)CO)O)C)/C=C	1-Naphthalenemethanol, decahydro-3-hydroxy-1,4a-dimethyl-6-methylene-5-[(2E)-3-methyl-2,4-pentadien-1-yl]-, (1R,3R,4aR,5S,8aR)	441
C[C@](Cl)(/C=C\Br)[C@@H](Cl)/C=C/C(=C/Cl)C(Cl)Cl	1,3,7-Octatriene, 8-bromo-1,5,6-trichloro-2-(dichloromethyl)-6-methyl-, (1Z,3E,5R,6S,7E)	270
COC1=C(O)C2=C(OC(=CC2=O)C2=CC(O)=C(O)C=C2)C=C1O	Nepetin 	1131
CC(=CCC(Br)C(C)=CC(Cl)Cl)CBr	4,8-dibromo-1, 1-dichloro-3,7-dimethyl-2,6-octadiene	729
CN1C[C@H]2[C@]3([C@@H]1C[C@@H](C=C3)OC)c4cc5c(cc4C(=O)O2)OCO5	3-Epimacronine	646
[H][C@@]23C=C(COC(C)=O)C[C@]1(O)C(=O)C(C)=C[C@@]1([H])[C@@]2(O)[C@H](C)C[C@@]4(OC(=O)C(C)CC)[C@](C)(COC(=O)/C(C)=C\C)[C@@]34[H]	12-deoxyphorbol-13-(2-methylbutyrate)-16-angelate-20-acetate	285
[H][C@@]8(O[C@@H]5C=C4CC[C@]2([H])[C@]([H])(CC[C@]3(C)[C@@H](c1ccc(=O)oc1)CC[C@]23O)[C@@]4(C)CC5)O[C@@H](C)[C@H](O[C@]6([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@@H](O[C@]7([H])O[C@@H](C)[C@H](O)[C@@H](O)[C@H]7O)[C@H]8O	Urginin	220
COc3ccc(C=c1oc(=O)cc1c2ccc(O)cc2)cc3	Rubrolide F	315
Oc1cc(cc(O)c1O)[C@H]3Oc2cc(O)cc(O)c2C[C@H]3O	Epigallocatechin	103
[H][C@@]15C[C@@H](OCC)C=C[C@@]14c3cc2OCOc2cc3[C@H](OC)O[C@]4([H])CN5	N-Demethyl-8[beta]-ethoxypretazettine	328
[H][C@]46CC[C@]2([H])[C@]([H])(CC[C@]3(C)[C@@H](c1ccc(=O)oc1)[C@@H](O)C[C@]23[H])[C@@]4(C)CC[C@H](O[C@]5([H])O[C@H](CO)[C@H](O)[C@H](O)[C@H]5O)C6	16[beta]-hydroxy-5[beta]-bufa-20,22-dienolide-3[beta]-O-[beta]-d-galactoside	819
[H][C@@]46CC[C@]3(C)[C@]([H])(CC[C@]2([H])[C@@]1([H])C(C(=C)C)CC[C@]1(C)CC[C@]23C)[C@@]4(C)CC[C@H](OC(=O)/C=C/c5ccc(OC)c(O)c5)C6(C)C	20(29)-lupene-3[beta]-isoferulate	518
O[C@]2(CC[C@H]([C@H]1[C@H]2CC/C(=C)C1)C(C)C)C	Millecrol B	193
[H][C@@]23[C@@H](O)[C@@]4(C)C=C1C(=O)[C@@H](C)C[C@]12C(=O)[C@H](C)CC([C@](C)(C)O)[C@]3(O)OO4	Steenkrotin B	314
CC7=C3c8c(C)cc(O)c9c(O[C@@H]2O[C@H](CO[C@@H]1OC[C@@H](O)[C@H](O)[C@H]1O)[C@@H](O)[C@H](O)[C@H]2O)ccc(OC3(O)c6c(O[C@@H]5O[C@H](COC4OC[C@@H](O)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]5O)ccc(O)c6C7=O)c89	1',2-binaphthalen-4-one-2',3-dimethyl-1,8'-epoxy-1,4',5,5',8,8'-hexahydroxy-5',8-di-O-[beta]-xylopyranosyl(1[to]6)-[beta]-glucopyranoside	526
CC(C)(O)C(O)CC[C@]4(C)C(=O)CC[C@H](C)[C@@H]4CC[C@]3(C)[C@@H](C)CC[C@@H]2OC1(O)CCC23O[C@@]1(C)C	Sodwanone N	418
CC(C)C1=C(C(=C2C(=C1)CC[C@@H]3[C@@]2(CCCC3(C)C)C(=O)O)O)O	Carnosic acid	445
CC1=CC[C@H]2[C@@](CCC[C@@]2([C@H]1CC/C(=C/CO)/C)C)(C)CO	Villenol	936
CO[C@@H]1C[C@@H]2[C@@]3(CCN2Cc4c3cc5c(c4)OCO5)[C@@H]6[C@H]1O6	Augustine	635
C=C[C@H](/C=C\c1ccc(O)cc1)c2ccc(O)cc2	(-)-Nyasol	563
C/C(C)=C/CC/C(=C/CC/C(C)=C/CC/C(C)=C/Cc1cc(O)cc(C)c1O)C(=O)O	Sargahydroquinoic acid	250
CC3=CC(=O)[C@H](OC(=O)c1ccoc1)[C@@]4(C)[C@@H](OC(=O)c2ccoc2)C[C@H]5C[C@]34OC5(C)C	1[alpha],9[beta]-Difuranoyloxy- 2-oxo-3-enedihydro-[beta]-agarofuran	551
[H][C@@]23C[C@@H](C)C=CC=CC[C@@]1([H])O[C@]([H])(C[C@H]1C)[C@H](O)C[C@@]4([H])OC(=O)[C@](O)([C@H](OC(=O)CCC)C[C@@]([H])(C[C@@H](O)C2)O3)[C@@]4([H])O	Mandelalide C	294
[H][C@@]24CC1(C=CC(=O)C=C1)c3c(O)c(OC)cc(CCN2)c34	Crotsparine	382
CC5(C)CCC4(C)CC[C@]3(C)C(=CC(O)C2C1(C)CCC(O)C(C)(C)C1CCC23C)C4C5	11[alpha]-Hydroxy-[beta]-amyrin	261
CC=C1CC(=C)C(C)(O)C(=O)OCC2=CCN3(=O)C2C(OC1=O)CC3	Spartioidine N-oxide	794
"O=C1OCC2=CCN3[C@H]2C(CC3)OC(=O)[C@@]2(C[C@H]([C@@]1(C)O)C)O[C@H]2C	"	Jacobine	777
[H][C@]34CCC(=C)[C@@H](CC[C@]2(O)[C@@H](C)CC[C@]1([H])OC(C)(C)C(=O)CC[C@]12C)[C@]3(C)CC[C@@H](OC(C)=O)C(C)(C)O4	3-epi-Sodwanone K 3-acetate	587
CC12CCC(CC1CCC3C2CCC4(C3(CCC4C5=CC(=O)OC5)O)C)OC6C(C(C(C(O6)CO)O)O)O	Desglucouzarin	837
CO[C@H]1C[C@H](O)O[C@H](C)[C@H]1O	Cymarose	458
CC(=CCC1=C2C(=C(C=C1O)O)C(=O)C[C@H](O2)C3=CC=CC=C3)C	Glabranin	883
CC(=CCC1=C2C(=C(C=C1O)OC)C(=O)CC(O2)C3=CC=C(C=C3)O)C	Isoxanthohumol	881
COc3cc(C[C@@H]2COc1cc(OC)c(O)c(OC)c1C2=O)ccc3O	Zebrinin B	575
O=C2C[C@H]3[C@@H]([C@@H]1C(\CC[C@@H]1C)=C2\C)C3(C)C	Millecrone B	191
C[C@H](CCC=C(C)C)[C@H]1CC[C@@]2([C@@]1(CC[C@]34[C@H]2CC[C@@H]5[C@]3(C4)CC[C@@H](C5(C)C)O)C)C	Cycloartenol	870
CC(=O)Cc4cc(=O)c3c(C)cc(O)c([C@@H]2OC(COC(=O)/C=C/c1ccc(O)cc1)[C@@H](O)[C@H](O)[C@H]2O)c3o4	4H-1-Benzopyran-4-one, 7-hydroxy-8-[6-O-[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propen-1-yl]-[beta]-D-glucopyranosyl]-5-methyl-2-(2-oxopropyl)-	412
CCCC1=NCCCC1	Coniceine	804
[H][C@@]12C[C@@H](O)C=C[C@]15CC[N@]2Cc4c(OC)c3OCOc3cc45	Powelline	330
COc3c(O)cc2oc1c(OC)c(OC)c(OC)c(O)c1c(=O)c2c3O	1,6,8-trihydroxy-2,3,4,7-tetramethoxyxanthone	340
CCCC/C=C\C#CCCCCCCCCCN(C)CCNC	Clathculin B	544
Oc1ccc5cc1Oc2ccc(cc2)CCc3cccc(O)c3Oc4cccc(c4)CC5	Marchantin C	768
CC1=C(C(=C(C(=C1OC)C(=O)C(C)C)O)CC2=C(C(=C(C(=C2O)C)OC)C(=O)C(C)C)O)O	Alpha kosin	1047
[H][C@@]45CCC1=C(CC[C@@]2(C)[C@@]1(C)CC[C@@]23O[C@H](C(=O)CC)CC3C)[C@@]4(C)CC[C@H](O)C5(CO)CO	(23S)-17[alpha],23-epoxy-3[beta],28,29-trihydroxy-27-norlanost-8-en-24-one	528
CC(C)(C=C)/C=C/C(C)(C)O	Yomogi alcohol	901
COc3ccc(C[C@@H]2COc1cc(OC)cc(OC)c1C2=O)cc3	5,7-dimethoxy-3-(4-methoxybenzyl)chroman-4-one	614
[H][C@@]8(O[C@@H]1[C@@H](O)[C@@H](O)CO[C@@]1([H])O[C@@H]7C[C@H](O)CC6=CC[C@]2([H])[C@]([H])(CC[C@@]5(C)[C@@]2([H])C[C@]4([H])O[C@]3(C[C@H](O)[C@@H](C)CO3)[C@@H](C)[C@@]45[H])[C@]67C)O[C@@H](C)[C@H](O)[C@@H](O)[C@H]8O	24S,25S)-3[beta],24-dihydroxyspirost-5-en-1[beta]-yl O-[alpha]- L-rhamnospyranosyl-(1[to]2)-[alpha]-L-arabinopyranoside	408
[H][C@@]5(O[C@H]4C[C@@]3([H])[C@]2([H])CC=C1C[C@@H](O)CC[C@]1(C)[C@@]2([H])[C@H](O)C[C@]3(C)[C@@]4([H])[C@H](C)[C@@H](O)CCC(C)C)O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O	(22S)-Cholest-5-ene-3[beta],11[beta],16[beta],22-tetrol 16-O-[alpha]-L-rhamnopyranoside	694
CC(C)C1=C(C(=C2C(=C1)[C@@H]([C@@H]3[C@@H]4[C@@]2(CCCC4(C)C)C(=O)O3)O)O)O	Rosmanol	1109
[H][C@@]12CC=C(C=O)[C@](O)(C=O)[C@@]1(C)CC[C@H](C)C2=C	Muzigadial	297
[H][C@@]8(O[C@@H]1[C@@H](O)[C@@H](O)CO[C@@]1([H])O[C@@H]7C[C@H](O)CC6=CC[C@]2([H])[C@]([H])(CC[C@@]5(C)[C@@]2([H])C[C@]4([H])O[C@]3(CC[C@@H](C)CO3)[C@@H](C)[C@@]45[H])[C@]67C)O[C@@H](C)[C@H](O)[C@@H](O)[C@H]8O	(25R)-3[beta]-hydroxyspirost-5-en-1[beta]-yl O-[alpha]-L-rhamnopyranosyl-(1[to]2)-[alpha]-L-arabinopyranoside	665
O=C7[C@@]31/C(=C/C[C@@H]3[C@H](C)[C@@]2(OC1)OC(C[C@H]2O)(C)C)[C@@H]6CC[C@H]5Cc4nc%12c(nc4[C@H](OC)[C@]5(C)[C@@]6(O)C7)C[C@@H]%13CC[C@H]%11/C%10=C/[C@@H]9O[C@]8(O[C@](C)(CO)C[C@H]8O)[C@@H](C)[C@]9(O)[C@@]%10(C)[C@H](O)C[C@@H]%11[C@@]%13(C)C%12	Cephalostatin 11	485
[H][C@@]34CC[C@@]2([H])[C@]1([H])CC[C@]([H])([C@H](C)CCCC=C)[C@@]1(C)CC[C@]2([H])[C@@]3(C)C[C@H](OS(=O)(=O)O)[C@@H](OS(=O)(=O)O)C4	Halistanol disulfate B	619
C/C(=C/Br)/C=C/[C@H](Cl)[C@](C)(Cl)/C=C\Br	1,3,7-Octatriene, 1,8-dibromo-5,6-dichloro-2,6-dimethyl-, (1Z,3E,5R,6S,7E)	273
CC(=O)C1=CC(=C(C=C1)O)OC	Acetovanillone	1122
c1cc2ccn3c2c(c1)c4cc5c(cc4c3=O)OCO5	Hippadine	655
COC(=O)C1=CC(=C(C(=C1)O)O)O	Methyl gallate	1009
O=c5c2NCCC13C=C(Br)C(O)C(C1O)[N+]4=c(c23)c6c(CC4)c(Br)[nH]c56	14-bromo-1-hydroxy-discorhabdin V	125
CC(=O)N1CCCC(=C1)[C@H]2CCCCN2	Ammodendrine	970
[H][C@@]56C[C@H](OC(C)=O)[C@@]4([H])[C@]1(C)CO[C@H](C1NC(=O)c2ccccc2)[C@H]3O[C@]34CC5=CC[C@@]7(C)[C@@]6(C)C[C@@H](O)[C@]7([H])[C@H](C)N(C)C	O2-Natafuranamine	596
Oc2c1ncccc1c(cc2O)c5cn(cc5c4cc(O)c(O)c3ncccc34)CCCN6CC(C)CCCCCCC6	Halitulin	417
COC1=C(C(=C(C2=C1C=CC(=O)O2)O)OC)O	6,8-dihydroxy-5,7-dimethoxycoumarin	1095
C=C(C)C(C)CCC1(C)C(Cl)C(O)CC3(C)C1CC=C2COC(=O)C23	Hamiltonin A	185
[H][C@@]12C=C(COC(C)=O)CCC=C(C=O)CC[C@@]1([H])C(=C)C(=O)O2	Cyclodeca[b]furan-6-carboxaldehyde, 10-[(acetyloxy)methyl]-2,3,3a,4,5,8,9,11a-octahydro-3-methylene-2-oxo-, [3aS-(3aR*,6Z,10Z,11aS*)]- (9CI)	661
CC1(C=CC2=C(O1)C=C(C3=C2OC4=C(C3=O)C=CC=C4O)O)C	6-Deoxyisojacareubin	1004
CC1=C([C@]2(CCCC([C@@H]2CC1=O)(C)C)C)CCC3=COC=C3	Hispanone	932
CCCCCCCCCCCCCC(=O)O[C@H]1CC[C@@H](C(=O)N(C1)C)NC(=O)[C@@H]([C@@H]([C@H]([C@@H](/C=C/C(C)C)O)O)O)OC	Bengamide B	424
C[C@@H]1CCC=C2[C@]1(C[C@@H](CC2)C(C)(C)O)C	Valerianol	914
C[C@@H]1CC[C@@]2(CC[C@@]3(C(=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(C[C@H]([C@@H]([C@@]5(C)CO)O)O)C)C)[C@@H]2[C@H]1C)C)C(=O)O	Asiatic acid	976
CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCO	1-triacontanol	1048
CCCCCCCC/C=C\CCCCCCCC(=O)N	Oleamide	1059
C1=CC(=CC=C1C2=CC(=O)C3=C(O2)C(=C(C=C3O)O)[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O	Vitexin	1086
CC(C)(C(CC1=C(C=C2C(=C1)C=CC(=O)O2)O)O)O	Peucedanol	1079
[H][C@]35Cc1ccc(cc1)Oc7c(OC)c(OC)cc6CCN(C)[C@]([H])(Cc2ccc(cc2)Oc4c(OC)c(OC)cc(CCN3C)c45)c67	Cycleanine	380
[H][C@@]12CC[C@H](C=C)[C@@]1(C)CC[C@@]4([H])[C@@]2([H])[C@H](O)C=C3C[C@H](OC(C)=O)CC[C@@]34COC(C)=O	Pregna-5, 20-diene-3[alpha], 7[alpha], 19-triol 3[alpha], 19-diacetate	172
[H][C@@]6(O[C@@H]5C[C@H](O)CC4=CC[C@]1([H])[C@]([H])(CCC3(C)[C@@]1([H])C[C@H](O[C@]2([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@]3([H])[C@H](C)[C@@H](O)CCC(C)C)[C@]45C)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O	(22S)-1[beta]-[([beta]-D-glucopyranosyl)oxy]-3[beta],22-dihydroxycholest-5-en-16[beta]-yl [beta]-D-glucopyranoside	664
CC(=CCC1=C(C(=CC(=C1)[C@@H]2CC(=O)C3=C(C=C(C=C3O2)O)O)/C=C/C(C)(C)O)OC)C	Burttinone	940
Oc1ccc4c(c1)CCc2ccc(cc2)Oc3cc(ccc3O)CCc5ccc4c(O)c5	Riccardin C	770
CC1=CCC(CC1)C(=C)C	Limonene	912
NC(CC2C4C(=O)C=C1SC3CC12c5c(N3)c(=O)c7[nH]cc6CC[N+]4=c5c67)C(=O)O	1-Alanyl discorhabdin D	135
CC1C(C2=C(O1)C3=CC=CC=C3C(=O)C2=O)(C)C	Dunnione	874
C1=CC(=CC(=C1)O)C(=O)O	3-Hydroxybenzoic acid	947
COc3ccc(C[C@@H]2COc1cc(O)c(OC)c(O)c1C2=O)cc3O	5,7-dihydroxy-3-(3-hydroxy-4-methoxybenzyl)chroman-4-one	572
CC(C)C(=O)C1=C(C=C(C(=C1O)CC=C(C)C)O)O	2-(2-methylpropanoyl)-4-prenylphloroglucinol	889
COC(=O)Cc1cc(O)c(C/C=C(C)/CC/C=C(C)/[C@H](OC(C)=O)C(=O)/C=C(C)\C)cc1O	8'-acetoxyrietone	160
C1CCN2C[C@H]3C[C@@H]([C@@H]2C1)CN4C3=CC=CC4=O	Thermopsine	968
CC(=C)[C@@H]1CC[C@]2(C)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12	Lupeol	175
C1=CC(=CC=C1[C@@H]2[C@@H](C(=O)OC3=CC(=CC(=C23)O)O)[C@H]4[C@H](C5=C(C=C(C=C5OC4=O)O)O)C6=CC=C(C=C6)O)O	Diphysin	1093
CC1=CC2=C(C(=O)C=CC2=O)C(=C1)O	7-methyljuglone	437
OCC=C1C[C@@H](C)[C@@](C)(O)C(=O)OCC2=CCN3(=O)[C@H]2[C@H](OC1=O)CC3	Eruciflorine N-oxide	800
COc3cc(C[C@@H]2COc1cc(OC)c(O)c(O)c1C2=O)ccc3O	Zebrinin A	574
C1CN[C@@H]2CC3=CC=CC=C3C4=C2C1=CC5=C4OCO5	Anonaine	1102
[H][C@]12C=C(C)[C@@H](O)CCC(C)=C[C@@H](O)[C@]1([H])C(=C)C(=O)O2	Tatridin A	431
C=C1CCC(Br)C(C)(C)C12CCC(C)(Cl)C(Br)C2	Nidificene	579
C1=CC(=C(C(=C1)O)O)O	Pyrogallol	1025
C1=COC2=CC(=CC(=C2C1=O)O)O	5,7-Dihydroxychromone	1012
COC1=C(C=C(C=C1)/C=C\2/C(=CC(=O)O2)C3=CC=C(C=C3)O)Br	3-bromorubrolide F	306
COc3c(C/C=C(C)\C)cc([C@@H]2CC(=O)c1c(O)cc(O)cc1O2)cc3C/C=C(C)/C	Abyssinone-V 4'-methyl ether	941
[H][C@]12C(=C)CC[C@@H](O)[C@]1(C)CC[C@@H](C(C)C)[C@@H]2O	(+)1[beta],6[alpha]-dihydroxy-4(15)-eudesmene	476
CC(=O)OC5COC(OCC2=CC4C(CC(OC(=O)/C=C/c1cn(C)cn1)C3(C)C=CC2(O)O3)C(C)=CC[C@@H]4C(C)C)C(OC(C)=O)C5O	Eleuthoside B	582
CN1CC[C@]2([C@@H]1CC(=O)C=C2)C3=CC(=C(C=C3)OC)OC	Mesembrenone	1036
C=CCCCCCC/C=C/C[C@H](OC(C)=O)[C@H](C)NC(C)=O	2-acetamido-3-acetoxy-5,13-tetradecadiene	142
[H][C@]48CC[C@]1([H])[C@]([H])(CC[C@@]3(C)[C@@]1([H])C[C@]2([H])O[C@@H](C=C(C)C)[C@H](O)[C@@H](C)[C@@]23[H])[C@@]4(C)CC[C@H](O[C@]5([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O[C@]6([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O[C@]7([H])O[C@@H](C)[C@H](O)[C@@H](O)[C@H]7O)C8	[beta]-D-Glucopyranoside, (3[beta],5[beta],16[beta],22R,23S)-16,23-epoxy-22-hydroxycholest-24-en-3-yl O-6-deoxy-[alpha]-L-mannopyranosyl-(1[to]2)-O-[beta]-D-glucopyranosyl-(1[to]2)- (9CI)	494
CC(=CCCC(=C)C=C)C	Myrcene	910
CC1=C(OC)C=C(O)C(C(CCC)=O)=C1O	Aspidinol	741
COC1=CC=C(C=C1)C2=CC(=O)C3=C(C=C(C=C3O2)O)O	Buddleoflavonol	975
C=CC(C)(C)c2[nH]c1ccccc1c2/C=C/3NC(=O)[C@H](C)NC3=O	Neoechinuline A	720
O[C@@H]1C[C@@](CC[C@]2([H])C3=CC[C@@]4(C)[C@@]2([H])C[C@@]5([H])[C@]4([H])[C@H](C)[C@]6(OC[C@H](C)CC6)O5)(O)[C@]3(C)C[C@H]1O	9(11)-Dehydroagapanthagenin	749
COc3c(O)cc2OC[C@@H](Cc1ccc(O)cc1)C(=O)c2c3OC	5,6-dimethoxy-7-hydroxy-3-(4'-hydroxybenzyl)-4-chromanone	359
COc1cc2ccc(=O)oc2cc1O	Scopoletin	755
CC1(C2C1C3C(CCC3(C)O)C(=C)CC2)C	Spathulenol	924
C[C@@]12CCC[C@@]([C@H]1CC[C@]34C2=CC[C@@H](C3)C(=C)C4)(C)C(=O)O	Grandiflorenic acid	973
CC1(C=CC2=C(O1)C=C3C(=C2O)C(=O)C(=CO3)C4=CC=C(C=C4)O)CO	Erysubin B	855
C1=CC=C(C(=C1)C2=CC(=O)C3=C(C=C(C=C3O2)O)O)O	5,7,2'-Trihydroxyflavone	937
CN1[C@@H]2CC[C@H]1CC(C2)OC(=O)C(CO)C3=CC=CC=C3	Atropine	988
[H][C@]46CC[C@]2([H])[C@]([H])(CC[C@]3(C)[C@@H](C1=CC(=O)OC1)CC[C@]23O)[C@@]4(C)CC[C@H](O[C@]5([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)C6	Digitoxigenin-glucoside	279
CCC(C)C(=O)O[C@@]12C[C@H]([C@]3([C@H]([C@@H]1C2(C)C)C=C(C[C@]4([C@H]3C=C(C4=O)C)O)COC(=O)C)O)C	12-deoxyphorbol-13-(2-methylbutyrate)-20-acetate	282
[H][C@]5([C@H](C)CC[C@H](O)C(C)(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)CC[C@@]6(C)[C@]3([H])CC[C@@]2([H])C(C)(C)[C@H](O)CC(=O)[C@@]24C[C@@]34C(=O)C[C@]56C	Sutherlandioside C	547
CC(Cl)(/C=C/[C@H](Cl)[C@](C)(Cl)/C=C/Cl)CBr	1,5-Octadiene, 8-bromo-1,3,4,7-tetrachloro-3,7-dimethyl-, (1E,3R,4S,5E)-rel-	214
[H][C@]45C[C@@]3([H])[C@]2([H])CCC1C[C@@H](N)CC[C@]1(C)[C@@]2([H])CC[C@]3(C)[C@@]4([H])[C@@](O)(CCCC(C)C)C(=O)O5	Clionamine B	288
COC1=C(C2=C3C(CC4=CC5=C(C=C42)OCO5)NCCC3=C1)OC	Nornantenine	1101
C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)O	Isoquercitrin	838
O=c3cc(c1ccc(O)c(Br)c1)c(=Cc2ccc(O)c(Br)c2)o3	3',3-dibromorubrolide E	312
[H][C@@](O[C@@H]1O[C@H](C)[C@@H](O)[C@H](OC)[C@H]1O)([C@@H](C)O)[C@H](CC=O)OC	Lilacinobiose	461
[H][C@@]15C[C@@H](OC)C=C[C@@]14c3cc2OCOc2cc3[C@H](OCC)O[C@]4([H])CN5	N-Demethyl-8[alpha]-ethoxypretazettine	327
[H][C@]45CC[C@H](C)[C@@]3(CC[C@@]([H])([C@@]2(C)CC[C@]1([H])OC(C)(C)C(=O)CC[C@]12C)O3)[C@]4(C)CCC(=O)C(C)(C)O5	Yardenone	595
C[C@]12CCC[C@]3([C@H]1[C@@H](C[C@]4([C@@]3(CCC5=COC=C5)O)CO4)OC2=O)C	Leonotinin	934
CC(C)[C@H]1CC[C@@H]2[C@@]1(CC[C@]3([C@]2(CC[C@@]4([C@@H]3CC=C5[C@H]4CC[C@@H](C5(C)C)O)C)C)C)C	Simiarenol	1078
C/C/1=C/CCC(=C)/C=C\[C@@H](CC1)C(C)C	1,6-Cyclodecadiene, 1-methyl-5-methylene-8-(1-methylethyl)-, (1E,6E,8S)	632
C1[C@H](OC2=C(C1=O)C=CC(=C2)O)C3=CC(=C(C=C3)O)O	Butin	951
O=C1C([H])([H])[C@]7(O[H])[C@@]([H])(C2=C([H])C([H])([H])[C@@]3([H])[C@]([H])(C([H])([H])[H])[C@]4(OC([H])([H])[C@@]123)OC(C([H])([H])[H])(C([H])([H])[H])C([H])([H])[C@]4([H])O[H])C([H])([H])C([H])([H])[C@@]6([H])C([H])([H])c5nc%13c(nc5C([H])([H])[C@]67C([H])([H])[H])C([H])([H])[C@]%12([H])C([H])([H])C([H])([H])[C@@]%11([H])C%10=C([H])[C@@]9([H])O[C@@]8(OC([H])([H])[C@@](O[H])(C([H])([H])[H])C([H])([H])C8([H])[H])[C@]([H])(C([H])([H])[H])[C@@]9(O[H])[C@@]%10(C([H])([H])[H])[C@@]([H])(O[H])C([H])([H])[C@]%11([H])[C@@]%12(C([H])([H])[H])C%13([H])[H]	Cephalostatin 16	490
[H][C@@]46CC[C@]1([H])[C@]([H])(CC[C@@]3(C)[C@@]1([H])C[C@H](O[C@]2([H])O[C@H](COC(C)=O)[C@@H](O)[C@H](O)[C@H]2O)[C@]3([H])[C@H](C)[C@@H](O)CCC(C)C)[C@@]4(C)[C@H](O[C@]5([H])O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)C[C@H](O)C6	(22S)-16[beta]-[(6-O-acetyl-[beta]-D-glucopyranosyl)oxy]-3[beta],22-dihydroxy-5[alpha]-cholestan-1[beta]-yl [alpha]-L-rhamnopyranoside	667
[H][C@]45CN2CC[C@H](OC(=O)c1ccc[nH]1)C(O)[C@@]2([H])[C@]([H])(CN3C(=O)CCC[C@@]34[H])C5	13-(2'-pyrrolecarboxyl)calpurmenine	816
[H][C@@]6(O[C@H]5C[C@@]4([H])[C@]3([H])CC=C2C[C@@H](O[C@]1([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)CC[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@]5(O)[C@H](C)C(=O)CCC(C)C)OC[C@H](O)[C@H](O)[C@H]6O	16[beta]-[([alpha]-L-arabinopyranosyl)oxy]-3[beta]-[([beta]-D-glucopyranosyl)oxy]-17[alpha]-hydroxycholest-5-en-22-one	499
CC(=O)C1=C(C(=C(C(=C1OC)OC)OC)OC)O	2-hydroxy-4,5,6-trimethoxy-acetophenone	1051
CN1CCC2OC(=O)C(O)(CC(C(C(=O)OCC(=CC1)C2=O)(C)OC(=O)C)C)C(O)C	Floridanine	783
C/C=C/C(=O)C1C(=CCCC1(C)C)C	[alpha]-Damascone	930
C1=CC=C2C(=C1)C(=CC(=O)C2=O)O	2-Hydroxy-1,4-naphthalenedione	1011
COc3cc(O)c2C(=O)C(O)(Cc1ccc(OC)c(OC)c1)COc2c3	3,5-dihydroxy-7-methoxy-3-(3',4'-dimethoxybenzyl)-4-chromanone	567
COc2cc1oc(=O)ccc1c(C/C=C(C)/C)c2OC	Microfolicoumarin	532
[H][C@]3([C@H](C)CC/C=C(C)\C)CC[C@@]4([H])[C@]2([H])[C@@H](O)C=C1C[C@@H](O)CC[C@]1(COC(C)=O)C2CC[C@]34C	Cholest-5,24-diene-3[beta], 7[beta], 19-triol 19-acetate	154
O=C2c1c(cccc1)N(c3c2c(OC\C=C(/C)C)cc(O)c3)C	Tegerrardin B	609
C[C@]12CCC(C[C@H]1[C@@]3(CC[C@@H]4[C@]5(CC[C@@H](C([C@@H]5CC[C@]4(C3=CC2)C)(C)C)OC)C)C)(C)C	Sawamilletin	1111
Cc2cc(O)cc3oc(=O)c1c(O)cccc1c23	Autumnariol	231
[H][C@]1(CSC(=O)N1)[C@@]1(O)C[C@@]2([H])C[C@@]([H])(CC[C@]([H])(C)\C=C/CC\C(C)=C/C(=O)O2)O1	Latrunculin B	184
C=C(C)C1=CC=C(C)CCC=C(C)CC2C=C(CC1)C(=O)O2	(+)-(10R*)-Cembra-1E,3E,7E,11Z,16-pentaen-20,10-olide	539
C=C1C[C@H]2C=C(CC[C@](O)(C(C)C)C=C[C@@](C)(O)CC[C@@H]1O)C(=O)O2	(+)-(1S*,4S*,7R*,10R*)-1,4,7-Trihydroxycembra-2E,8(19),11Z-trien-20,10-olide	542
C[C@]12CCCC([C@@H]1CC=C([C@@]2(C=O)O)C=O)(C)C	Warburganal	651
COC(=O)Cc1cc(O)c(C/C=C(C)/CC/C=C(C)/[C@H](O)C(=O)/C=C(C)\C)cc1O	Rietone	159
C1[C@@H]([C@H](OC2=CC(=CC(=C21)O)O)C3=CC(=C(C(=C3)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O	Gallocatechin gallate	943
CO[C@H]1C[C@H]2[C@]3(C=C1)c4cc5c(cc4[C@@H](N2C[C@@H]3O)O)OCO5	Haemanthidine	639
Cn8cnc(SC1[C@@H]4C(=O)C=C2S[C@@H]3C[C@@]12c5c(N3)c(=O)c7[nH]cc6CC[N+]4=c5c67)c8C[C@H](N)C(=O)O	Discorhabdine H	218
[H][C@]23CC=CC(=O)O[C@@H](CO)C[C@@H](O)C4C[C@@H](C)[C@@]([H])(CC=CC=C[C@H](C)C[C@]([H])(C[C@H](O[C@]1([H])O[C@@H](C)[C@H](O)[C@@H](O)[C@H]1OC)C2)O3)O4	Mandelalide A	292
CC2=CC(C)CC(C)OC(=O)C(C(C)C)NC(=O)C(Cc1ccc(O)c(I)c1)N([CH3])C(=O)C(C)NC(=O)C(C)C2	Geodiamolide TA	707
C[C@@H]3CC1C(C)(C)C14O[C@]5(C)C=C2C(=O)[C@@H](C)CC2(C3=O)C4C5O	Steenkrotin A	308
[H][C@@]27C[C@@]16C[C@H](Nc3c1c5=[N+]2CCc4c[nH]c(c3=O)c45)SC6=CC7=O	Discorhabdin D	141
[H][C@@]6(O[C@H]5CC[C@@]1(C)C(=CC[C@]2([H])[C@]1([H])CC[C@@]4(C)[C@@]2([H])C[C@H](O[C@]3([H])O[C@@H](C)[C@H](O)[C@@H](OC(C)=O)[C@H]3O)[C@]4([H])[C@H](C)[C@@H](O)CCC(C)C)C5)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O	(22S)-3[beta]-[([beta]-D-glucopyranosyl)oxy]-22-hydroxycholest-5-en-16[beta]-yl 3-O-acetyl-[alpha]-L-rhamnopyranoside	392
CCCCCCCCCCCCCCCC(=O)O	palmitic acid	896
c1ccc(cc1)/C=C/C2Cc3cccc(c3C(=O)O2)O	Typharin	642
CCCC(C1=C(O)C=C(OC)C=C1O)=O	Desaspidinol	742
CCCCC[C@H](CNCC=CC=CCCC)O	Pseudodistamine	763
COC(=O)C[C@@H]1[C@](C)(C=CC(=O)C1(C)C)[C@H]1[C@@H](OC(=O)C)[C@H](O)[C@@]2(C(=CC[C@@H]2C2=CCOC2=O)C1=C)C	Turraflorin F	811
COC1=CC=C(C=C1)C2=C(C(=O)C3=C(C(=C(C(=C3O2)OC)O)OC)O)OC	Araneosol	1092
[H][C@@]13OC(CO)[C@@H](O)[C@H](O)[C@@]1([H])OC(=O)c2cc(O)c(OC)c(O)c23	Bergenin	284
[H][C@@]13CC[C@]4(C)C=C[C@@]1(CCC2=C(C)C(=O)C(O)=C[C@]23C)C4	ent-2-hydroxy-norbeyer-1,4,15-trien-3-one	691
CCCCCCCCCCCCCCCCCCCCCCCCCCCCOC(=O)/C=C/C1=CC(=C(C=C1)O)OC	erythrinasinate B	1074
[H][C@@]12C[C@](C)(C(=O)O)CC[C@]1(C)CC[C@]4(C)C2=CC[C@]3([H])[C@@](C)(CCC(=O)O)[C@H](C(=C)C)CC[C@]34C	20-Epikoetjapic acid	554
[H][C@@]34CC[C@@H](C)[C@@](C)(CC[C@@]12O[C@H](CC[C@@H]1C)[C@]2(C)CCC(=O)C(C)C)C3=CC[C@@H](O)C(C)(C)O4	Sodwanone W	593
C/C(C)=C\C(=O)OC[C@@]1(C)CCC[C@@]3(C)C1=CC=c2cc(C(C)C)c(=O)c(O)c23	11-Hydroxy-19-(3-methylbuten-3-oyloxy)-abieta-5,7,9(11),13-tetraene-12-one	371
CC(C)C(C)/C=C/[C@@]1([C@H]2[C@H](CC3[C@@]2(CCC4C3CCC5[C@@]4(CC[C@@H](C5)N)C)C)OC1=O)O	Clionamine A	287
C[C@@]12[C@@H](OC([C@@H]([C@@H](CC)C)O)=O)[C@H](OC=O)[C@@](C(=C)[C@@]1(O)C(=O)C[C@]2(C=3C=COC3)[H])([C@]4(C)[C@@H](CC(OC)=O)[C@](COC(C)=O)(C)OC(=O)C[C@@H]4OC(C)=O)[H]	Prieurianin	960
C[C@@H]1[C@]2([C@@H](C[C@@](O2)(C)CO)O)O[C@@H]3[C@]1([C@]4([C@@H](C[C@H]5[C@H](C4=C3)CC[C@@H]6[C@@]5(CC7=C(C6)N=C8[C@@H]([C@]9([C@@H](CC[C@@H]1[C@@H]9C[C@H]([C@]2(C1=C[C@H]1[C@@]2([C@@H]([C@@]2(O1)[C@@H](C[C@@](O2)(C)CO)O)C)O)C)O)CC8=N7)C)O)C)O)C)O	Cephalostatin 13	487
[H][C@@]35Cc1cc(OC)c(OC)cc1c4c2OCOc2cc(CCN3C)c45	Dicentrine	375
C1=CC(=CC=C1C2=COC3=CC(=CC(=C3C2=O)O)O)O	Genistein	945
C/C=C/C1=CC2=C(C(=C1)OC)O[C@H]([C@@H]2C)C3=CC4=C(C=C3)OCO4	Licarin b	863
COc2ccc(/C=C\c1cc(O)c(OC)c(OC)c1)cc2OC	Combretastatin A-5	682
[H][C@@]7(O[C@H]6[C@@H](O)CO[C@@]([H])(O[C@H]5C[C@@]4([H])[C@]3([H])CC=C2C[C@@H](O[C@]1([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)CC[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@]5(O)[C@H](C)C(=O)CCC(C)C)[C@@H]6OC(C)=O)OC[C@@H](O)[C@H](O)[C@H]7O	3[beta]-[([beta]-D-glucopyranosyl)oxy]-17[alpha]-hydroxy-16[beta]-[(O-[beta]-D-xylopyranosyl-(1[to]2)-2-O-acetyl-[alpha]-L-arabinopyranosyl)oxy]cholest-5-en-22-one	497
c1ccc(cc1)CC2c3cccc(c3C(=O)O2)O	Typhaphthalide	641
COC1=CC=C(C=C1)CCC(=O)C2=C(C=C(C=C2O)OC)O	Calomelanone	1014
O=C2C[C@@H](c1ccc(O)cc1)Oc3cc(O)cc(O)c23	Naringenin	263
C1[C@@H]([C@@H]([C@H]([C@@H](O1)OC2=C(OC3=CC(=CC(=C3C2=O)O)O)C4=CC=C(C=C4)O)O)O)O	Kaempferol 3-o-arabinoside	1099
[H][C@@]12[C@H](O)CCN1CCC2COC(=O)/C(C)=C\C	9-angelylplatynecine	111
C[C@@H](CCC[C@@H](C)CCC/C(=C/COC(=O)C)/C)CCCC(C)C	Phytol acetate	1046
C[C@](Cl)(/C=C\Br)[C@H](Cl)/C=C/C(=C/Cl)C(Cl)Cl	1,3,7-Octatriene, 8-bromo-1,5,6-trichloro-2-(dichloromethyl)-6-methyl-, (1Z,3E,5R,6R,7E)	271
CC(C)([C@@H]1CC2=C(O1)C=C3C(=C2)C=CC(=O)O3)O	Marmesin	1077
O=C1c3c(O/C(=C1/O)c2ccc(O)cc2)cc(O)cc3O	Kaempferol	106
CC5(C)C=Cc4cc(c3coc2cc1OC(C)(C)C(O)Cc1c(O)c2c3=O)c(O)cc4O5	Kraussianone 6	352
COC1=CC=C(C=C1)C2=CC(=O)C3=C(C(=C(C=C3O2)OC)O)O	Ladanein	1120
CC=C1C[C@@H](C)[C@@](C)(O)C(=O)OCC2=CCN3[C@H]2[C@H](OC1=O)CC3	Integerrimine	771
C[C@@H]1CC[C@@]2(CC[C@@]3(C(=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CC[C@@H](C5(C)C)OC(=O)C)C)C)[C@@H]2[C@H]1C)C)C	Alpha-amyrin acetate	1081
CCC/C=C/C=C/CCC[C@@]1(O[CH3])C=C[C@H](CC(=O)O[CH3])OO1	1,2-Dioxin-3-acetic acid, 6-(4,6-decadienyl)-3,6-dihydro-6-methoxy-, methyl ester, [3[alpha],6[alpha],6(4E,6E)]-(+)- (9CI)	722
CCC[C@H](C)C[C@H](C)C[C@H](C)C1OC(=O)C(C)=C1C	Capensifuranone	165
Cc2ccc([C@@]1(C)CCCC1(C)C)cc2	(-)-Cuparene	773
C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O	Astragalin	848
C[C@H](C/C=C/C(C)(C)O)[C@H]1CC[C@@]2([C@@]1(CC[C@]34[C@H]2CC[C@@H]5[C@]3(C4)CC[C@@H](C5(C)C)O)C)C	Cycloart-23-ene-3,25-diol 	1116
COc3cc(O)c2c(=O)c(Cc1ccc(O)cc1)coc2c3	5-hydroxy-3-4-hydroxybenzyl)-7-methoxy-4-chromone	689
C[C@@H]1C/C(=C/C(=O)O[C@@H]2CCN3[C@@H]2C(=CC3)COC(=O)[C@]1(C)O)/C	Doronenine	1000
C/C=C(/C)\C(=O)O[C@H]1C[C@@]2(C(=O)C=C(O2)C(=C)[C@H]([C@@H]3[C@@H]1C(=C)C(=O)O3)O)C	Isocentratherin	1076
CC3(C)[C@]1(Br)O[C@@H]1[C@H]2O[C@@]2(C)[C@]34C[C@H](Br)[C@@](C)(Cl)C[C@@H]4O	Prepacifenol epoxide	580
CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCOC(=O)\C=C\C1=CC=C(O)C(OC)=C1	(E)-tetratriacontyl-3-(4-hydroxy-3-methoxyphenyl)-2-propenate	1123
COc3c(O)cc2OC[C@@H](Cc1ccc(O)cc1)C(=O)c2c3O	3,9-Dihydro-autumnalin	245
COC1=C(C=C(C=C1)[C@@H]2CC(=O)C3=C(C=C(C=C3O2)O)O)O	Hesperetin	1043
CC(C)C1CCC(=C)C=C1	[beta]-Phellandrene	921
C1CNC(=O)C2=C(NC=C21)C(=O)O	Makaluvic acid C	256
CC=C1C[C@@H](C)[C@@](C)(O)C(=O)OC[C@@H]2[C@@H]3[C@H](OC1=O)CCN3(=O)C[C@H]2O	Rosmarinine N-oxide	798
O[C@@H]%13C[C@@](O[C@]%13%12O[C@H]%11/C=C%10/[C@@H]9CC[C@@H]2[C@](C)(Cc1nc3c(nc1C2)C[C@@]8(C)[C@H](C3)CC[C@H]7/C6=C/[C@@H]5O[C@@]4(OC[C@@](O)(CC4)C)[C@H]([C@]5(O)[C@@]6(C)[C@H](O)C[C@@H]78)C)[C@H]9C[C@@H](O)[C@]%10(C)[C@@]%11(O)[C@@H]%12C)(C)CO	Cephalostatin 7	481
[H][C@]3([C@H](C)CCCC(C)C)CC[C@@]4([H])[C@]2([H])[C@@H](O)C=C1C[C@@H](O)CC[C@]1(COC(C)=O)C2CC[C@]34C	Cholest-5-ene-3[beta],7[beta],19-triol 19-acetate	153
O=Cc1ccc(O)cc1	p-Hydroxybenzaldehyde	776
C/C(=C\Cc1cc(=O)c(C)cc1=O)CCC/C(C)=C\C(=O)CC(C)C	2,5-Cyclohexadiene-1,4-dione, 2-methyl-5-[(2E,7Z)-3,7,11-trimethyl-9-oxo-2,7-dodecadien-1-yl]-	724
CO[C@@]1(C)C=C[C@@](O)(C(C)C)CCC2=C[C@H](CC(C)=CCC1)OC2=O	(-)-(1S*,4R*,10R*)-1-Hydroxy-4-methoxycembra-2E,7E,11Z-trien-20,10-olide	537
[H][C@@]9(O[C@H]6C[C@@]5([H])[C@]4([H])CC=C3C[C@@H](O[C@]2([H])O[C@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@@H](O)[C@H](O)[C@H]2O)CC[C@]3(C)[C@@]4([H])CC[C@]5(C)[C@@]6(O)[C@H](C)C(=O)CCC(C)C)OC[C@H](O)[C@H](O[C@]7([H])OC[C@@H](O)[C@H](O)[C@H]7OC(=O)c8cc(OC)c(OC)c(OC)c8)[C@H]9OC(C)=O	3[beta]-[(O-[beta]-D-glucopyranosyl-(1[to]6)-[beta]-D-glucopyranosyl)oxy)]-17[alpha]-hydroxy-16[beta]-[(O-(2-O-3,4,5-trimethoxybenzoyl-[beta]-D-xylopyranosyl)-(1[to]3)-2-O-acetyl-[alpha]-L-arabinopyranosyl)oxy]cholest-5-en-22-one	504
c1cc(c(cc1[C@@H]2[C@@H](Cc3c(cc(cc3O2)O)O)O)O)O	Epicatechin	101
CC1=CC[C@H](CC1=O)C(=C)C	(R)-Carvone 	1056
C1CCN(C(C1)C2=NCCC2)C=O	Smipine	971
CC2(C)[C@@H](Br)CC[C@@]2(C)[C@]1(O)C[C@H](Br)[C@@](C)(Cl)CC1	1-Deacetoxy-8-deoxyalgoane	199
[H][C@@]12C[C@@H](OC)C=C[C@]15CC[N@]2Cc4cc3OCOc3cc45	Buphanisine	366
[H][C@@]8(O[C@H]7[C@@H](O)CO[C@@]([H])(O[C@H]6C[C@@]5([H])[C@]4([H])CC=C3C[C@@H](O[C@]2([H])O[C@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@@H](O)[C@H](O)[C@H]2O)CC[C@]3(C)[C@@]4([H])CC[C@]5(C)[C@@]6(O)[C@H](C)C(=O)CCC(C)C)[C@@H]7OC(C)=O)OC[C@@H](O)[C@H](O)[C@H]8OC(=O)c9ccc(OC)c(OC)c9	3[beta]-[(O-[beta]-D-Glucopyranosyl-(1[to]6)-[beta]-D-glucopyranosyl)oxy)]-17[alpha]-hydroxy-16[beta]-[(O-(2-O-3,4-dimethoxybenzoyl-[beta]-D-xylopyranosyl)-(1[to]3)-2-O-acetyl-[alpha]-L-arabinopyranosyl)oxy]cholest-5-en-22-one	503
COc1cc2c(c(c1OC)O)c(=O)c1c(n2COC(=O)C)cccc1	Toddaliopsin C	753
"C1CCNC(=O)C1
"	2-Piperidone	967
[H][C@@]5(O[C@H]4C[C@@]3([H])[C@]2([H])CC=C1C[C@@H](O)CC[C@]1(C)[C@@]2([H])[C@H](O)C[C@]3(C)[C@@]4([H])[C@H](C)[C@@H](O)CCC(C)C)O[C@@H](C)[C@H](O)[C@@H](OC(C)=O)[C@H]5OC(C)=O	(22S)-cholest-5-ene-3[beta],11[alpha],16[beta],22-tetrol 16-O-(2,3-di-O-acetyl-[alpha]-L-rhamnopyranoside)	509
O=C6C=CC15CC(Nc2c1c4=NCCc3c[nH]c(c2=O)c34)SC5=C6	11H-8,13a-Methanopyrrolo[4',3',2':4,5]quino[7,8-d][1,3]benzothiazepine-6,11(2H)-dione, 3,5,7,8-tetrahydro-, (8R,13aR)-	131
C5C(=O)C(C)(C4CC[C@@]3([C@]2(CC[C@@]1(CC[C@@](CC1C2=C[C@H](C3[C@]4(C)C5)OC)(C)CO[H])C)C)C)C	30-hydroxy-11[alpha]-methoxy-18[beta]-olean-12-en-3-one	977
COC(=O)/C=C/C1=CC=CC=C1	Methyl cinnamate	1040
C1[C@@H]([C@@H](OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O	(+)-epicatechin-3-o-gallate	1119
C=C(C)C(O)Cc4c(O)cc3occ(c2cc1C=CC(C)(C)Oc1cc2O)c(=O)c3c4O	Kraussianone 7	355
C[C@H]1CCCCCCCNCCCNC1	Haliclorensin	557
[H][C@]13CC=CC(=O)[C@]1(C)C[C@]2(O)OC(=O)C(C)=C2C3	9a[beta]-hydroxy- 4a[alpha]H-3,5[alpha],8[beta]a- trimethyl-4,4a,8a,9-tetrahydronaphtho-([2,3b]-dihydrofuran-2-one)-8-one	349
C1=CC(=CC=C1C2=CC(=O)C3=C(C(=C(C(=C3O2)[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)O)O	vicenin-2	949
"C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)COC(=O)C5=CC(=C(C(=C5)O)O)O)O)O)O)O
"	kaempferol-3-O-beta-d-glucopyranoside	840
CN1CCc2cnc3c(=O)c(N)cc1c23	Makaluvamine C	128
CCCCCCCCC=CC=C[C@H](N)C	(3E,5E)-tetradeca-3,5,-diene-2-amine	764
C[C@@H]1CC[C@H]2[C@@H]1[C@H]3[C@H](C3(C)C)CC[C@]2(C)O	Viridiflorol	920
CC1=CC(=O)C(=C(C)C)CC1	Piperitenone	1104
Cc2cc1CCC(=O)c1c3[nH]c(CO)cc23	Dilemmaone B	266
O=C2C[C@@H](c1ccc(O)c(O)c1)Oc3cc(O)cc(O)c23	Eriodictyol	320
C=C(C)C(Br)CC(Br)/C(C)=C/C=N/OCc1c(F)c(F)c(F)c(F)c1F	2,7-Octadienal, 4,6-dibromo-3,7-dimethyl-, O-[(2,3,4,5,6-pentafluorophenyl)methyl]oxime, (2E)-	208
C[C@@](Cl)(/C=C\Br)[C@@H](Cl)/C=C/C(=C/Cl)C(Cl)Cl	1,3,7-Octatriene, 8-bromo-1,5,6-trichloro-2-(dichloromethyl)-6-methyl-, (1Z,3E,5R,6S,7Z)	274
[H][C@@]6(O[C@H]4C[C@@]3([H])[C@]2([H])CC=C1C[C@@H](O)CC[C@]1(C)[C@@]2([H])[C@H](O)C[C@]3(C)[C@@]4([H])[C@H](C)[C@@H](O)CCC(C)C)O[C@@H](C)[C@H](O)[C@@H](OC(=O)c5ccc(OC)cc5)[C@H]6OC(C)=O	(22S)-cholest-5-ene-3[beta],11[alpha],16[beta],22-tetrol 16-O-{2-O-acetyl-3-O-(p-methoxybenzoyl)-[alpha]-L-rhamnopyranoside}	511
NC1[C@@H]4C(=O)C=C2S[C@@H]3C[C@@]12c5c(N3)c(=O)c7[nH]cc6CC[N+]4=c5c67	1-Amino discorhabdin D	133
[H][C@]13C[C@](C)(Cl)[C@@H](Br)C[C@@]1(O)[C@]2(C)CC[C@@H](C)[C@]2(C)O3	Ibhayinol	197
CC5(C)C=Cc4cc(c3coc2cc1OC(C)(C)C=Cc1c(O)c2c3=O)c(O)cc4O5	Kraussianone 1	342
CC(C(=O)O)O	Lactic acid	1024
[H][C@]46CC[C@]2([H])[C@]([H])(CC[C@]3(C)[C@@]([H])(C1=CC(=O)OC1)CC[C@]23O)[C@@]4(C)[C@H](O)C[C@H](O[C@H]5O[C@@H](C)[C@H](O)[C@H](OC)[C@@H]5O)C6	Acovenoside A	715
Nc1cc3=NCCc2c[nH]c(c1=O)c23	Makaluvamine I	239
[H][C@@]6(O[C@H]5C[C@@]4([H])[C@]3([H])CC=C2C[C@@H](O)C[C@@H](O[C@]1([H])O[C@@H](C)[C@H](O)[C@@H](O)[C@H]1O)[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@]5([H])[C@H](C)[C@@H](O)CCC(C)C)O[C@@H](C)[C@H](O)[C@@H](O)[C@H]6O	(22S)-16[beta]-[([alpha]-L-rhamnopyranosyl)oxy]-3[beta],22-dihydroxycholest-5-en-1[beta]-yl [alpha]-L-rhamnopyranoside	406
[H][C@@]8(O[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@@]1([H])O[C@H]6CC[C@@]2(C)C(=CC[C@]3([H])[C@]2([H])CC[C@@]5(CO)[C@@]3([H])C[C@]4([H])O[C@@H](O)[C@H](C=C(C)C)[C@@H](C)[C@@]45[H])C6)O[C@@H](C)[C@H](OC(=O)c7ccc(O)cc7)[C@@H](O)[C@H]8O	Saundersioside G	671
CC(=C)[C@@H]1CC[C@]2([C@H]1[C@H]3CC[C@@H]4[C@]5(CCC(=O)C([C@@H]5CC[C@]4([C@@]3(CC2)C)C)(C)C)C)C	Lupenone	1003
O[C@@H]1CC2=CC[C@]([C@@](C[C@@]3([H])[C@]4([H])[C@H](C)[C@]5(OC[C@H](C)CC5)O3)([H])[C@]4(C)CC6)([H])[C@@]6([H])[C@@]2(C)C[C@H]1O	Yuccagenin	746
CCCC1CCCCN1	Coniine	802
[H]n3c1ccccc1c(=O)c2c(OC)c(OC)c(OC)cc23	Toddaliopsin A	750
COC1=C(C(=C2C(=C1)OC(=CC2=O)C3=CC=CC=C3)O)OC	Mosloflavone	884
[H][C@@]46CC[C@]1([H])[C@]([H])(CC[C@@]3(C)[C@@]1([H])C[C@H](O[C@]2([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@]3([H])[C@H](C)[C@@H](O)CCC(C)C)[C@@]4(C)[C@H](O[C@]5([H])O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)C[C@H](O)C6	(22S)-16[beta]-[([beta]-D-glucopyranosyl)oxy]-3[beta],22-dihydroxy-5[alpha]-cholestan-1[beta]-yl [alpha]-L-rhamnopyranoside	666
C=C1CC=CC(C)(OC(C)=O)CCC2C(C(=O)C/C=C(C)/C)=COC(OC(C)=O)C12	Tsitsixenicin D	152
CC#CC#CC#CC#CC#CC=C	1-Tridecene-3,5,7,9,11-pentayne	631
COc3cc(OC)c2C(=O)[C@H](Cc1ccc(O)cc1)COc2c3	5,7-dimethoxy-3-(4-hydroxybenzyl)-4-chromanone	565
CCC[C@H]1CCC(CN1C)O	N-Methylpseudoconhydrine	806
[H][C@@]34CC[C@]1([H])C(=CC[C@]2(C)[C@@]([H])([C@H](C)N(C)C)[C@H](O)C[C@@]12C)C=C3CC[C@H](N(C)C)[C@@H]4C	31-Demethylbuxaminol A	607
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O	Oleanolic acid	1132
COc3ccc(CC2COc1cc(OC)cc(O)c1C2=O)cc3	7-O-methyl-3,9-dihydroeucomin	362
C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)C(=O)O)O)O)O)O	Kaempferol 3-glucuronide	843
[H][C@@]12[C@H](O)CCN1(=O)CC[C@@H]2COC(=O)/C(C)=C\C	9-angelylplatynecine-4-oxide	112
CC(=O)O[C@H]1[C@H]([C@@H]2[C@]([C@H](CCC2(C)C)O)([C@@]3([C@@]1(O[C@@](CC3=O)(C)C=C)C)O)C)O	forskolin	821
CC1(C)C=Cc2c(O1)c(O)cc3oc(=O)ccc23	Cedrecoumarin A	704
CN1CCC2OC(=O)C(O)(CC(C(C(=O)OCC(=CC1)C2=O)(C)O)C)C(Cl)C	Desacetyldoronine	793
[H][C@@]8(O[C@H]7[C@@H](O)CO[C@@]([H])(O[C@H]6C[C@@]5([H])[C@]4([H])CC=C3C[C@@H](O[C@]2([H])O[C@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@@H](O)[C@H](O)[C@H]2O)CC[C@]3(C)[C@@]4([H])CC[C@]5(C)[C@@]6(O)[C@H](C)C(=O)CCC(C)C)[C@@H]7OC(C)=O)OC[C@@H](O)[C@H](O)[C@H]8O	3[beta]-[(O-[beta]-D-Glucopyranosyl-(1[to]6)-[beta]-D-glucopyranosyl)oxy)]-17[alpha]-hydroxy-16[beta]-[(O-[beta]-D-xylopyranosyl-(1[to]3)-2-O-acetyl-[alpha]-L-arabinopyranosyl)oxy]cholest-5-en-22-one	692
CC(=O)Cc3cc(=O)c2c(C)cc(O)c([C@@H]1OC(CO)[C@@H](O)[C@H](O)[C@H]1O)c2o3	Aloeresin	411
C1=CC(=CC=C1C2=CC(=O)C3=C(O2)C=C(C(=C3O)[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)O	Isovitexin	1087
CN1CCc2c[nH]c3c(=O)c(=O)cc1c23	Damirone B	129
CC=C1C[C@@H](C)[C@@](C)(O)C(=O)OC[C@@H]2C(=O)[C@H](OC1=O)CCN(C)CC2	1,2-Dihydrosenkirkine	796
C1[C@H]([C@H](OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O	Epicatechin gallate	942
[H][C@@]7(O[C@H]4C[C@@]3([H])[C@]2([H])CC=C1C[C@@H](O)CC[C@]1(C)[C@@]2([H])CC[C@]3(C)[C@@]4(O)[C@H](C)C(=O)CCC(C)C)OC[C@H](O)[C@H](O[C@]5([H])OC[C@@H](O)[C@H](O)[C@H]5OC(=O)c6ccc(OC)cc6)[C@H]7OC(C)=O	3[beta],16[beta],17[alpha]-trihydroxycholest-5-en-22-one 16-O-(2-O-4-methoxybenzoyl-[beta]P-d-xylopyranosyl)-(1[to]3)-(2-O-acetyl-[alpha]-l-arabinopyranoside)	390
O=C5CC[C@@]1(C=CNc2c1c4=NCCc3c[nH]c(c2=O)c34)C=C5Br	Discorhabdine G	280
[H][C@@]24CC1(C=CC(=O)C=C1)c3c(O)c(OC)cc(CCN2C)c34	Glaziovine	377
C/C(=C\CC(Br)/C(C)=C/C=N/OCc1c(F)c(F)c(F)c(F)c1F)CCl	2,6-Octadienal, 4-bromo-8-chloro-3,7-dimethyl-, O-[(2,3,4,5,6-pentafluorophenyl)methyl]oxime, (2E,6E)-	211
[H][C@@]23C=C(COC(C)=O)C[C@]1(O)C(=O)C(C)=C[C@@]1([H])[C@@]2(O)[C@H](C)C[C@@]4(OC(=O)C(C)C)[C@](C)(COC(=O)/C(C)=C\C)[C@@]34[H]	12-deoxyphorbol-13-isobutyrate-16-angelate-20-acetate	283
[H][C@@]12CCC(C(C)CCC(CC)C(C)C)[C@@]1(C)CC[C@@]1([H])[C@H]2CC=C2CC(CC[C@]12C)O[C@@H]1O[C@H](COC(=O)CCCCCCCCCCCCCCCCCC)[C@@H](O)[C@H](O)[C@H]1O	3-O-[beta-D-(6'-nonadecanoate)glucopyranosyl]-beta-sitosterol	1128
COc3ccc(CC2(O)COc1c(OC)c(OC)cc(O)c1C2=O)cc3OC	3,5-dihydroxy-7,8-dimethoxy-3-(3',4'-dimethoxybenzyl)-4-chromanone	566
[H][C@@]35c2cc1OCOc1cc2CN4CCC(=C[C@H](O)[C@H]3O)[C@@]45[H]	Lycorine	329
[H][C@]12[C@@H](CO)CCN1CC[C@H]2OC(=O)/C(C)=C\C	7-angelylplatynecine	110
CCO[C@@H]1[C@H]2OC(=O)[C@@]3(CCCC(C)(C)C23)C2=C(O)C(O)=C(C=C12)C(C)C	7-ethoxyrosmanol	1134
C[C@@]12CC[C@H]3[C@]([C@@]14[C@H](O4)C(=O)O[C@H]2C5=COC=C5)(C(=O)C[C@@H]6[C@@]37COC(=O)C[C@@H]7OC6(C)C)C	Limonin	1041
[H][C@]8(O[C@H]4CC[C@@]1(C)C(=CC[C@]2([H])[C@]1([H])C[C@@H](OC(=O)/C(C)=C/C)[C@]3(C)[C@@H](C(C)=O)CC[C@]23O)C4)C[C@H](OC)[C@H](O[C@@]7([H])C[C@H](OC)[C@H](O[C@]6([H])O[C@H](C)[C@@H](O[C@@]5([H])C[C@H](OC)[C@H](O)[C@@H](C)O5)[C@H](OC)[C@H]6O)[C@@H](C)O7)[C@@H](C)O8	Pregn-5-en-20-one, 3-[(O-2,6-dideoxy-3-O-methyl-[beta]-D-ribo-hexopyranosyl-(1[to]4)-O-6-deoxy-3-O-methyl-[beta]-D-glucopyranosyl-(1[to]4)-O-2,6-dideoxy-3-O-methyl-[beta]-D-ribo-hexopyranosyl-(1[to]4)-2,6-dideoxy-3-O-methyl-[beta]-D-ribo-hexopyranosyl)oxy	455
CC1=CC[C@@H]([C@@H]/2[C@H]1C[C@@H]([C@@]3(C=C[C@@](O3)(/C(=C2)/CO[C@H]4[C@H]([C@@H]([C@@H](CO4)O)OC(=O)C)OC(=O)C)O)C)OC(=O)/C=C/C5=CN(C=N5)C)C(C)C	Eleuthoside A	581
[H][C@@]%10(O[C@H]7C[C@@]6([H])[C@]5([H])CC=C4C[C@@H](O[C@]3([H])O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O[C@]1([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]4(C)[C@@]5([H])CC[C@]6(C)[C@@]7(O)[C@H](C)C(=O)CCC(C)C)OC[C@H](O)[C@H](O[C@]8([H])OC[C@@H](O)[C@H](O)[C@H]8OC(=O)c9cc(OC)c(OC)c(OC)c9)[C@H]%10OC(C)=O	3[beta]-[(O-[beta]-D-glucopyranosyl-(1[to]4)-O-[beta]-D-glucopyranosyl-(1[to]6)-[beta]-D-glucopyranosyl)oxy)]-17[alpha]-hydroxy-16[beta]-[(O-(2-O-3,4,5-trimethoxybenzoyl-[beta]-D-xylopyranosyl)-(1[to]3)-2-O-acetyl-[alpha]-L-arabinopyranosyl)oxy]cholest...	505
CC1=C(C(CCC1)(C)C)/C=C/C(=O)C	[beta]-ionone	1010
CC=C1C[C@@H](C)[C@](O)(CO)C(=O)OCC2=CCN3[C@H]2[C@H](OC1=O)CC3	Usaramine	780
COc2c(O)c(O)c(O)c3C(=O)C(=Cc1ccc(O)cc1)COc23	Poleevansin	529
C[C@H](/C=C/[C@H](C)C(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3C2=CC=C4[C@@]3(CC[C@@H](C4)O)C)C	Ergosterol	832
COc1c2ccoc2nc3c1cc4c(c3OC)OCO4	Flindersiamine	629
COC1CC2C(=CC1O)C3CN2Cc4c3cc5c(c4)OCO5	Montabuphine	636
[H][C@@]23CC[C@@]1([H])C(C)(C)[C@@H](O)CC[C@]1(C)[C@@]2([H])C(=O)[C@H](O)C(C=C)=C3C	Niloticane	343
Oc2ccc(/C=C/c1cc(O)cc(O)c1)cc2	(E)-resveratrol	611
CC(C)/C=C/[C@H]([C@H]1[C@H]([C@H](C(=O)O1)OC)O)O	Non-6-enonic acid, 6,7,8,9-tetradeoxy-8-methyl-2-O-methyl-, [gamma]-lactone (9CI)	426
OCCc1ccc(cc1)O	Tyrosol	956
CC12CCC=CC1=CCC4C2CCC5(C)C(c3ccc(=O)oc3)CCC45O	14[beta]-hydroxybufa-3,5,20,22-tetraenolide	219
C[C@@]1(C[C@H]([C@]2([C@@H]1[C@@H](OC=C2)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)O)O)O	Harpagide	1002
CC1=CCC[C@]2([C@H]1C[C@@H](CC2)C(C)(C)O)C	[alpha]-Eudesmol	917
[H][C@]34C=C(C(=O)OC)[C@@]1(O)C=C[C@](C)(O1)[C@@H](OC(=O)/C=C/c2cn(C)cn2)C[C@@]3([H])C(C)=CC[C@@H]4C(C)C	Sarcodictyin A	583
[H][C@@]7(O[C@H]6C[C@@]5([H])[C@]4([H])CC=C3C[C@@H](O)C[C@@H](O[C@]2([H])O[C@H](CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)[C@@H](O)[C@H](O)[C@H]2O)[C@]3(C)[C@@]4([H])CCC5(C)[C@@]6([H])[C@H](C)[C@@H](O)CCC(C)C)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O	(22S)-1[beta]-[(O-[beta]-D-glucopyranosyl-(1[to]6)-[beta]-D-glucopyranosyl)oxy]-3[beta],22-dihydroxycholest-5-en-16[beta]-yl [beta]-D-glucopyranoside	396
[H][C@@]45CCC1=C(CC[C@@]2(C)[C@@]1(C)CC[C@@]23O[C@H](C(=O)CC)C[C@H]3C)[C@@]4(C)CC[C@H](O)[C@]5(C)CO	15-deoxoeucosterol	571
C[C@@H]3CC(=O)[C@H](OC(=O)c1ccoc1)[C@@]4(C)[C@@H](OC(=O)c2ccoc2)C[C@H]5C[C@]34OC5(C)C	1[alpha],9[beta]-Difuranoyloxy-2-oxodihydro-[beta]-agarofuran	550
C[C@@]12CCC[C@@]3([C@@H]1CC[C@]45[C@@]3(CC[C@](C4)(C(=C)C5=O)OC)C)OC2=O	13-methoxy-15-oxozoapatlin	433
CCCCCCCCCCCCCC(=O)O	n-Tetradecanoic acid	1053
[H][C@@]6(O[C@H]5[C@@H](O)CO[C@@]([H])(O[C@H]4C[C@@]3([H])[C@]2([H])CC=C1C[C@@H](O)CC[C@]1(C)[C@@]2([H])CC[C@]3(C)[C@@]4(O)[C@H](C)C(=O)CCC(C)C)[C@@H]5OC(C)=O)OC[C@@H](O)[C@H](O)[C@H]6O	3[beta]P,16[beta]P,17[alpha]-trihydroxycholest-5-en-22-one 16-O-[beta]-d-xylopyranosyl-(1[to]3)-(2-O-acetyl-[alpha]-l-arabinopyranoside)	389
Cn3cc4CCN=c5c2c(c1ccc(O)cc1)c[nH]c2c(=O)c3c45	Tsitsikammamine B	137
C[C@H]1[C@@H](CC[C@@H]2[C@@]1(CC3=C(C2=O)OC=C3C)C)O	Euryopsonol	966
COc1cc2c(cc1OC)[C@@H]3[C@@H]([C@H]([C@@H](C4=CCN([C@@H]34)C2)O)OC)O	Narcissidine	647
CC1=CC(=C(C2=C1C(=O)C=C(O2)CC(=O)C)[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)OC(=O)/C=C/C4=CC=CC=C4)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O	Aloeresin E	964
C[C@H]1[C@H]([C@]2([C@H]([C@@H](O1)O[C@@H]3C[C@@]4([C@H]5[C@@H](C(=O)[C@@]6([C@H](CC[C@@]6([C@@]5(C[C@H](C4=C[C@H]3O2)O)O)O)C7=COC(=O)C=C7)C)O)C)O)OC)O	Rubellin	1029
O=C1N3[C@H](C(=O)N[C@H]1Cc2ccccc2)C[C@@H](O)C3	Cyclo(L-trans-(4-hydroxyprolinyl)-L-phenylalanine)	425
C=C(C)C(C)CCC3(C)C(Cl)C(O)CC2(C)C1=C(COC1=O)C(=O)CC23	Hamiltonin D	188
C[C@H]1C[C@@H]2[C@@H]([C@@H](C(=O)O2)C)[C@@H](C3=C(C(=O)C[C@H]13)C)O	Geigerin	872
COC1=CC=C(C=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O	Kaempferide	885
[H][C@]14C[C@@H](OC)C=C[C@]15c3cc2OCOc2cc3[C@H](O)N4C[C@@H]5O	6-Hydroxycrinamine	316
COC(=O)C[C@@H]1[C@](C)(C=CC(=O)C1(C)C)[C@H]1[C@@H](OC(=O)C)[C@H](O)[C@@]2(C(=CC[C@H]2c2cocc2)C1=C)C	Turraflorin B	808
COC1=CC(=CC(=C1)O)C2=COC3=C(C2=O)C=CC(=C3)O	7,3'-dihydroxy-5'-methoxyisoflavone	1118
[H][C@@]35CC[C@]2(O)C[C@@H](O[C@@H]1O[C@@H](C)[C@H](O)[C@@H](O)[C@H]1O)C[C@@H](O)[C@]2(CO)[C@@]3([H])[C@H](O)C[C@]6(C)[C@@H](C4=CC(=O)OC4)CC[C@]56O	Ouabain	714
O[C@H](C[C@@H]2C(=C)CC[C@@H]1[C@@]3(C)CCCC(C)(C)C3CC[C@]12C)C=4COC(=O)C=4	Hamiltonin E	189
c1c2c(cc3c1OCO3)[C@H]4[C@H]5[C@H](CCN5C2)C[C@H]([C@H]4O)O	Zephyranthine	638
C[C@]12CCC(C[C@H]1[C@@]3(CC[C@@H]4[C@]5(CC[C@@H](C([C@@H]5CC[C@]4(C3=CC2)C)(C)C)O)C)C)(C)C	Taraxerol	1110
CC(=CCc1c(cc(c(c1O)C(=O)c2ccccc2)O)O)C	Methanone, phenyl[2,4,6-trihydroxy-3-(3-methyl-2-buten-1-yl)phenyl]	492
[H][C@@]12CC[C@H](OC(C)=O)[C@H](O)[C@]15CC[N@]2Cc4c(OC)c3OCOc3cc45	1-epideacetylbowdensine	515
CCCCCC/C=C/C#CCCCCCCCC(=O)O	Ximenynic acid	1073
CCCCC=CC#CC#CCCCCCCCC(=O)O	Exocarpic acid	1072
O=c2c(O)c(c1ccc(O)c(O)c1)oc3cc(O)cc(O)c23	Quercetin	317