SANC01046 Phytol acetate



Download SMILES        
Analog ID Similarity score SMILES

Selection options

Mcule | MolPort | All | None
MCULE-1447316045 1 [C@H](C)(CCCC(C)=CCOC(=O)C)CCC[C@H](C)CCCC(C)C
MolPort-039-337-879 1 CC(C)CCC[C@@H](C)CCC[C@@H](C)CCC\C(C)=C\COC(C)=O
MCULE-6156460578 0.87 C(OC/C=C(\C)/CC/C=C(\C)/C)(=O)C
MCULE-1470478178 0.87 CC(=O)OC/C=C(\CC/C=C(\C)/C)/C
MCULE-5441019625 0.87 C(OCC=C(CC/C=C(\C)/C)C)(=O)C
MolPort-003-855-596 0.87 CC(C)=CCC\C(C)=C\COC(C)=O
MolPort-006-121-794 0.87 CC(C)=CCCC(C)=CCOC(C)=O
MolPort-001-769-752 0.87 CC(C)=CCC\C(C)=C/COC(C)=O
MCULE-8114128388 0.85 C1CCCCCCCC/C(=C/C(=O)OCC)/CC1
MolPort-046-763-196 0.85 CCCCCCCCCCCCC\C=C\C(=O)OCC
MCULE-1110502851 0.84 C(C)(=CCCCCCC)COC(=O)CC
MolPort-003-929-616 0.84 CCC\C=C\COC(C)=O
MCULE-9731133687 0.83 C1CC/C(/CCC1)=C\C(=O)OCC
MCULE-3903546287 0.83 CC1C(=CC(OC(C)(C)C)=O)CCCC1
MCULE-1661513561 0.83 CC1CC(=CC(OC(C)(C)C)=O)CCC1
MCULE-1116373843 0.83 CCOC(C=C[C@@]1(CC[C@@](C)(CC1)[H])[H])=O
MCULE-6500424227 0.83 CCOC(/C=C/[C@@H]1CC[C@@H](C)CC1)=O
MCULE-5687333040 0.83 C(=CC1CCCCC1)C(OCC)=O
MCULE-3082785721 0.83 CC(OC(/C=C1\CCCCCC\1)=O)(C)C
MCULE-5586842007 0.83 CCCCCC=CC(=O)OC(C)(C)C
MCULE-4171275205 0.83 C(C)CCCC([H])=C([H])C(OCC)=O
MCULE-4411404253 0.83 C(C)(OCC=C(C)CCC=C(C)CC/C=C(\C)/C)=O
MolPort-000-153-748 0.83 CCOC(=O)C=C1CCCCCC1
MolPort-046-590-819 0.83 CCOC(=O)\C=C\[C@H]1CC[C@H](C)CC1
MolPort-003-913-208 0.83 CCCCC\C=C\C(=O)OCC
MolPort-002-135-206 0.83 CC(C)=CCC\C(C)=C\CC\C(C)=C\COC(C)=O
MolPort-003-986-521 0.83 CCOC(=O)\C=C\C1CCCCC1
MolPort-009-104-793 0.83 CCOC(=O)C=C(C)C12CC3CC(CC(C3)C1)C2
MolPort-044-878-151 0.83 CCOC(=O)C=C1C2CC3CC(C2)CC1C3
MolPort-044-903-863 0.83 CCOC(=O)C=C1CCC(C)CC1
MolPort-023-246-084 0.83 CCOC(=O)C=C1CCC(CC1)C(C)(C)C
MCULE-3878291254 0.81 CC(OC(C=C1C2CC(CC2)C1)=O)(C)C
MCULE-2221943770 0.81 O=C(OCC)/C=C/C1CCCC1
MCULE-3079324701 0.81 C(=C1/CCCCC/1)/C(OCC)=O
MCULE-2022772727 0.81 O(CC)C(C=CC1CCCC1)=O
MCULE-5525949786 0.81 CC(OC(C=C1C(C)(C)CCC1)=O)(C)C
MCULE-3739506947 0.81 CC1C(=CC(OC(C)(C)C)=O)CCC1
MolPort-001-790-557 0.81 CCOC(=O)C=C1CCCCC1
MolPort-044-903-871 0.81 CCOC(=O)\C=C1\CC2CCC1C2
MolPort-028-950-621 0.81 CCOC(=O)C=CC1CC2CCC1C2
MolPort-044-904-314 0.81 CCOC(=O)\C=C\C1CCCC1
MolPort-044-904-341 0.81 CCOC(=O)\C=C\C1CC2CCC1C2
MCULE-9372990721 0.80 C1(CC2C1CCC2)=CC(OCC)=O
MCULE-6747818247 0.80 CC(OC(C=C1C2CC2CCC1)=O)(C)C
MCULE-5869293075 0.79 C1C[C@]2(C)[C@@]([H])(CC/C(/C)=C/COC(=O)C)C(=C)CC[C@@]2([H])[C@@](C)(C(O)=O)C1
MCULE-8446771640 0.79 CC1CC(=CC(OC(C)(C)C)=O)CC1
MCULE-8193555834 0.79 CC(OC(C=C1CC(C)(C)CC1)=O)(C)C
MCULE-5583649862 0.79 CC1C(C)C(=CC(OC(C)(C)C)=O)C1
MolPort-035-705-908 0.79 CC(=O)OC\C=C(/C)CC[C@H]1C(=C)CC[C@@H]2[C@]1(C)CCC[C@]2(C)C(O)=O
MCULE-6605023747 0.78 C(C)(C(=O)OCC)=C(C)CCCCCC
MCULE-8774906136 0.78 C(C)(=CCCCCCC)C(=O)OCC
MolPort-044-907-405 0.78 CCCC(CCC)=CC(=O)OCC
MCULE-5918107257 0.77 C(C)C(=O)OCC=C(C)CC/C=C(\C)/C
MCULE-7698586282 0.77 CC(C(OCC=C(CC/C=C(\C)/C)C)=O)C
MCULE-5983144155 0.77 C(C)(OCC=C(C)CCC=C(C)C=O)=O
MCULE-5145737541 0.77 CC(OC(C=C1C2C(C2)CC1)=O)(C)C
MCULE-3941955944 0.77 C(OCC=C(CC/C=C(\C)/C)C)=O
MCULE-6334497175 0.77 O=COC/C=C(/CC/C=C(/C)\C)\C
MolPort-009-345-918 0.77 CC(C)C(=O)OCC=C(C)CCC=C(C)C
MolPort-006-114-216 0.77 CC(C)C(=O)OC\C=C(/C)CCC=C(C)C
MolPort-035-944-003 0.77 CC(C)=CCCC(C)=CCOC=O
MolPort-046-759-635 0.77 CC(=O)OC\C=C(/C)CC\C=C(/C)C=O
MolPort-001-797-113 0.77 CC(C)C(=O)OC\C=C(\C)CCC=C(C)C
MolPort-003-912-442 0.77 CCC(=O)OC\C=C(/C)CCC=C(C)C
MolPort-003-912-443 0.77 CC(C)=CCC\C(C)=C\COC=O
MCULE-1316154268 0.76 CC(OC(C=C1C(C)(C)CC1)=O)(C)C
MCULE-7811515870 0.76 O=C(/C=C1/CCCC/1)OCC
MCULE-7861856483 0.76 C(OCC)(=O)C=CC1CCC1
MCULE-3009202760 0.76 CC1C(=CC(OC(C)(C)C)=O)CC1
MCULE-8155504745 0.76 C(CCC(=CCOC(C)=O)C)=O
MCULE-8661398095 0.76 CCOC(C(C)=C1C(C)CCCCC1)=O
MCULE-3102057992 0.76 C(OC)(=O)C=CCCCCCC
MCULE-4024027310 0.76 C(OC)(=O)/C=C/CCCCCC
MolPort-006-113-750 0.76 CCOC(=O)C=C1CCCC1
MolPort-006-110-525 0.76 CCCCCCC=CC(=O)OC
MolPort-028-744-289 0.76 CCOC(=O)\C=C\C1CCC1
MolPort-046-701-924 0.76 CCOC(=O)C(\C)=C\C1CCCCC1
MolPort-028-949-468 0.76 CCOC(=O)C(C)=CC1CCCCC1
MCULE-7704363210 0.74 CCOC(/C(/C)=C1\CCC2(CC2)CC\1)=O
MCULE-3621676306 0.74 CCOC(C(C)=C1C2(CCCC2)CC1)=O
MCULE-6193394453 0.74 C1C[C@]2(C)[C@@]([H])(CC/C(/C)=C/COC(=O)C)C(=C)CC[C@@]2([H])[C@@](C)(COC(=O)C)C1
MCULE-9193800742 0.74 C1CC(OC(C)=O)C=CCCC1
MCULE-9358571952 0.74 COC(C=C1C(C(C)C)CCCCC1)=O
MCULE-2954267118 0.74 C1CC/C(/CCC1)=C\C(=O)OC
MCULE-6371108459 0.74 COC(C=CC1C2CCC(CC2)C1)=O
MCULE-1929932707 0.74 CCC1C(=CC(OC)=O)CCCCC1
MCULE-6189866164 0.74 COC(C=C1C(C)CCCCC1)=O
MolPort-035-705-909 0.74 CC(=O)OC\C=C(/C)CC[C@H]1C(=C)CC[C@H]2[C@@](C)(COC(C)=O)CCC[C@]12C
MolPort-046-702-848 0.74 CCC\C=C\COC(=O)\C=C\CCC
MolPort-002-499-604 0.74 CCOC(=O)\C=C\CCCCCl
MolPort-042-623-345 0.74 COC(=O)C=C1CCCCC1C
MCULE-1645946260 0.73 CCCC(C)=CC(OCC)=O
MCULE-3787684558 0.73 C(OC)(=O)C=CCCCCC
MCULE-5587277376 0.73 CCOC(C(C)=C1CC2CC(CC2)C1)=O
MolPort-029-996-232 0.73 CCC\C(C)=C/C(=O)OCC
MolPort-028-948-373 0.73 CCCC(C)=CC(=O)OCC
MCULE-4675404269 0.72 CC=C(C(OCC=C(CC/C=C(\C)/C)C)=O)C
MCULE-8877106409 0.72 COC(C=C1C2(CCCCC2)CC1)=O
MCULE-8564432592 0.72 COC(C=C1C2(CCCC2)CC1)=O
MCULE-6505560486 0.72 COC(C=C1C(C2CC2)CCCC1)=O
MCULE-7474056373 0.72 COC(/C=C1\CCC2(CC2)CC\1)=O
MolPort-006-119-068 0.72 C\C=C(/C)C(=O)OC\C=C(/C)CCC=C(C)C
MCULE-4895716264 0.71 C1/C(=C/C(OC)=O)/CCCC1
MCULE-8290420044 0.71 CCOC(C=C(C1CC1)C)=O
MCULE-8918279747 0.71 C(=CC1CCCC1)C(OC)=O
MCULE-2569553100 0.71 CC(OC(/C=C1\CC(C)(C)C\1)=O)(C)C
MCULE-1352596380 0.71 COC(/C=C/C1CCCC1)=O
MCULE-1047809631 0.71 C(/C(C)C)(\C(C)C)=C\CCC(C)=CC(OCC)=O
MCULE-6401227946 0.71 C(=C(C)CCC=C(C)CC)C(OCC)=O
MCULE-8833781603 0.71 CCCC(=O)OC/C=C(/CC/C=C(/C)\C)\C
MCULE-1088410365 0.71 C(C)(CC/C=C(\C)/C)=CCOC(=O)CCC
MCULE-9395210581 0.71 CC(C/C=C/C(=O)OC(C)(C)C)C
MCULE-1719758520 0.71 C(CC)(CCC)C=CC(=O)OC
MolPort-003-960-002 0.71 CCCC(=O)OC\C=C(/C)CCC=C(C)C
MolPort-003-848-899 0.71 CCOC(=O)\C=C\CC(C)C
MolPort-028-951-970 0.71 CCOC(=O)C=C(C)C1CC1
MolPort-024-504-101 0.71 COC(=O)\C=C\C1CCCC1
MolPort-027-574-799 0.71 COC(=O)C=C1CCCCC1
MolPort-002-139-890 0.71 CCOC(=O)\C=C(/C)CC\C=C(\C)CC
MolPort-003-960-030 0.71 CCCC(=O)OC\C=C(\C)CCC=C(C)C
MolPort-006-109-345 0.71 CCC\C=C\C(=O)OCC
MolPort-002-139-888 0.71 CCOC(=O)\C=C(/C)CCC=C(C(C)C)C(C)C
MCULE-6010231146 0.70 COC(C=CC1CC2C(C2)C1)=O
MCULE-7764991918 0.70 COC(C=C1CC2CC(CC2)C1)=O
MCULE-2950763490 0.70 COC(C=CC1CC2C(C2)CC1)=O
MolPort-027-835-581 0.70 CCCCCC\C=C(/C)C(=O)OC
MCULE-8612971671 0.69 CCOC(/C=C1\CCC\1)=O
MCULE-5035333331 0.69 C(=O)(OCC)C=CC1CC1
MCULE-9450414421 0.69 C1(CCCCC1OC(C)=O)=CC(C)C
MCULE-5927428406 0.69 C(F)(F)(F)C(CCCCCC)=CC(=O)OC(C)(C)C
MolPort-006-710-205 0.69 CCOC(=O)C=C1CCC1
MolPort-042-681-448 0.69 CCOC(=O)\C=C\C1CC1
MolPort-044-878-242 0.69 CCOC(=O)\C=C1\CCCC(C1)C(F)(F)F
MolPort-000-707-521 0.69 CC(C)\C=C1/CCCCC1OC(C)=O
MolPort-044-422-794 0.69 CC(C)(C)OC(=O)\C=C\C1CC1
MCULE-3507079471 0.68 O(C)C(C=CCCCC)=O
MCULE-6369272976 0.68 O=C(OCC=C(CC/C=C(\C)/C)C)C=CC=CC
MolPort-023-245-190 0.68 CCOC(=O)C=C(CC)CC
MolPort-044-175-405 0.68 CCCC\C=C\C(=O)OC
MolPort-025-942-228 0.67 COC(=O)\C=C\C1CCC1
MolPort-023-221-872 0.67 CC(=O)OC\C=C(\C)/C=C/C=C(/C)\C=C/C1=C(C)CCCC1(C)C
MolPort-046-647-489 0.67 CCOC(=O)\C=C1/CCCCCC1(F)F
MCULE-3388444808 0.67 CCOC(/C=C(\CC)/CC)=O
MCULE-8751707087 0.67 C1(C(C)(C)CCCC=1C)/C=C/C(/C)=C\C=C\C(\C)=C/COC(C)=O
MCULE-2797068826 0.67 C1(C(C)(C)CCCC=1C)/C=C/C(/C)=C/C=C/C(/C)=C/COC(C)=O
MCULE-3222341524 0.67 C1(C(C)(C)CCCC=1C)C=CC(C)=CC=CC(C)=CCOC(C)=O
MolPort-003-666-431 0.67 CC(=O)OC\C=C(/C)\C=C\C=C(/C)\C=C\C1=C(C)CCCC1(C)C
MolPort-046-690-899 0.67 CC(=O)OC\C=C(\C)/C=C/C=C(\C)/C=C/C1=C(C)CCCC1(C)C
MolPort-006-128-277 0.67 COC(=O)C=C1CCCC1
MolPort-003-850-859 0.67 [2H]C([2H])([2H])C1=C(\C=C\C(\C)=C\C=C\C(\C)=C\COC(C)=O)C(C)(C)CCC1([2H])[2H]
MolPort-023-298-794 0.66 CCCCCCCCCCC=C(C(=O)OCC)C(=O)OCC
MolPort-001-740-957 0.66 CC(CC[C@@]1(C)[C@H](C)CC[C@]2(C)C1CCC=C2COC(C)=O)CC(O)=O
MolPort-023-298-795 0.66 CCCCCCCCCCCCCCC=C(C(=O)OCC)C(=O)OCC
MCULE-9035965650 0.66 C1(C=CCCCCCCCC)CCCCCCC(=O)O1
MCULE-3998827933 0.66 C1CC2[C@@](CC[C@H]([C@]2(C)CCC(C)CC(=O)O)C)(C(COC(=O)C)=C1)C
MolPort-001-742-448 0.65 COC(=O)\C=C(\CC[C@@H]1C(=C)CC[C@@H]2C(C)(C)CCC[C@@]12C)COC(C)=O
MolPort-002-111-466 0.65 CC(=O)OCC1=C(C)CCC1C(C)=C
MolPort-005-944-726 0.65 CC(C)=CCCC(COC(C)=O)=CCCC(CO)=CCCC(C)=CCO
MolPort-006-121-402 0.65 CC12CCCC(C)(C)C1=CC(=O)O2
MolPort-044-875-734 0.65 CCOC(=O)C=C(C)C(C)C
MolPort-004-796-391 0.65 CCOC(=O)C(\F)=C\C1CCCCC1
MolPort-027-835-895 0.65 C[C@]12CCCC(C)(C)C1=CC(=O)O2
MolPort-019-992-901 0.65 C[C@@]12CCCC(C)(C)C1=CC(=O)O2
MolPort-023-171-789 0.65 CCOC(=O)C=C(C)C(C)(C)C
MolPort-046-588-849 0.65 CCOC(=O)\C=C(\C)C(C)C
MolPort-046-418-946 0.65 CCC(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4=C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OC(=O)CC
MolPort-035-748-826 0.65 CCOC(=O)C(F)=CC1CCCCC1
MCULE-5214550861 0.65 C12C(C)(C)CCC[C@]1(C)OC(=O)C=2
MCULE-5979426935 0.65 C12C(C)(C)CCCC1(C)OC(=O)C=2
MCULE-2185361459 0.65 O1C(C=C2[C@@]1(C)CCCC2(C)C)=O
MCULE-4858829873 0.65 CC1(C)C2=CC(O[C@]2(C)CCC1)=O
MCULE-9373742271 0.65 O(CC(=CCCC(CO)=CCCC(C)=CCO)CC/C=C(\C)/C)C(=O)C
MCULE-5321922003 0.65 C(C(CCCC)=O)=C(O)C(OCC)=O
MCULE-3195594472 0.65 CCOC(C=C(C(C)(C)C)C)=O
MCULE-7151123890 0.65 C1(COC(C)=O)=C(C)CCC1C(C)=C
MCULE-9567571073 0.65 C(OCC(=CCC(C)COC(C)=O)C)(C)=O
MCULE-6412891907 0.64 C(=C1/CCCCCCCCCCC/1)(/C#N)\C(OCC)=O
MCULE-1310747899 0.64 C1C[C@]2(C)[C@@]([H])(CCC3C(=O)OCC=3)C(=C)CC[C@@]2([H])[C@@](C)(C(=O)OC)C1
MCULE-7252099279 0.64 C1CC2(C(CCC(C2CCC2=CCOC2=O)=C)C(C(OC)=O)(C)C1)C
MCULE-3968607148 0.64 C(=C(C)CCCCCC)(C#N)C(OCC)=O
MCULE-2357370492 0.64 C1C[C@@]2(C)[C@@](CCC3C(=O)OCC=3)([H])[C@@H](CO)CC[C@]2([H])[C@](C)(CO)[C@@H]1O
MCULE-2928945887 0.64 C(=C(C)CCCCCCC)(C#N)C(OCC)=O
MolPort-039-052-687 0.64 C[C@@]1(CO)[C@H](O)CC[C@@]2(C)[C@H](CCC3=CCOC3=O)[C@@H](CO)CC[C@H]12
MolPort-001-837-376 0.64 CCCCC\C(C)=C(/C#N)C(=O)OCC
MolPort-001-554-327 0.64 CCOC(=O)C(C#N)=C1CCCCCCCCCCC1
MolPort-002-130-505 0.64 CCCCCCC\C(C)=C(\C#N)C(=O)OCC
MolPort-005-945-683 0.64 CC12CCCC(C)(C1CCC(=C)C2CCC1=CCOC1=O)C(O)=O
MolPort-005-945-684 0.64 COC(=O)C1(C)CCCC2(C)C(CCC3=CCOC3=O)C(=C)CCC12
MolPort-001-834-046 0.64 CCCCCC\C(C)=C(/C#N)C(=O)OCC
MolPort-002-499-509 0.64 CCOC(=O)\C=C\CCCCl
MolPort-039-338-474 0.64 C[C@]1(CC[C@]2(C)[C@@H](C1)CCC(C)(C)[C@H]1OC(=O)C=C21)C=C
MolPort-035-705-906 0.64 C[C@]12CCC[C@@](C)([C@@H]1CCC(=C)[C@@H]2CCC1=CCOC1=O)C(O)=O
MolPort-039-052-550 0.64 COC(=O)[C@@]1(C)CCC[C@]2(C)[C@@H](CCC3=CCOC3=O)C(=C)CC[C@@H]12
MolPort-005-944-967 0.64 C[C@@]1(CO)CCC[C@@]2(C)[C@H](CCC3=CCOC3=O)C(=C)CCC12
MCULE-8366514445 0.64 C(=C(C)CCCCC)(C#N)C(OCC)=O
MCULE-3965188829 0.64 C1C[C@@]2(C(CCC([C@H]2CCC2C(=O)OCC=2)=C)[C@@](CO)(C)C1)C
MCULE-3178410726 0.64 C1CC(C(O)=O)(C)C2C(C)(C(CCC3=CCOC3=O)C(CC2)=C)C1
MCULE-5929092480 0.64 [C@@]12(C)CCCC(CO)(CO)[C@@]1([H])CC[C@H](CO)[C@@]2([H])CCC1=CCOC1=O
MCULE-8091940383 0.64 C1C[C@]2(C)[C@@]([H])(CCC3C(=O)OCC=3)C(=C)CC[C@@]2([H])[C@@](C)(C(=O)O)C1
MCULE-3101455434 0.63 C(COC)=CCCCC=C
MCULE-9966949324 0.63 [C@H]1(OC(=O)C)C[C@@]2([H])[C@H](C)CC(=O)[C@@H](C(C)C)[C@@]2([H])C=C1C
MCULE-1374093397 0.63 C1=CC2CC1C1C(COC(=O)C)=CC12
MCULE-5470759504 0.63 C1(OC(=O)CC)C(C)=CCC(C(=C)C)C1
MolPort-035-706-205 0.63 CC(C)[C@H]1[C@H]2C=C(C)[C@H](C[C@H]2[C@H](C)CC1=O)OC(C)=O
MolPort-032-338-490 0.63 CCOC(=O)C(C)=C1CCC1
MCULE-5466298425 0.62 C(=C1/CCCCCC/1)(\C#N)/C(OCC)=O
MCULE-7736060966 0.62 C1(CCCCC1)C=C(C#N)C(=O)OC(C)(C)C
MCULE-1592446720 0.62 C1C[C@@]2([C@@]([H])([C@@](CO)(C)C1O)CCC(=C)[C@H]2CCC1C(=O)OCC=1)C
MCULE-3823700520 0.62 C(C)(C)(C)C=CC(=O)OCC
MCULE-7577519245 0.62 C1(=O)C(C)=C(CO1)CCCCC(O)C(C)O
MCULE-4808865357 0.62 CCOC(C(C#N)=C(C1CCCCC1)C)=O
MCULE-7613417621 0.62 O=C1C(CC[C@H]2[C@@]3(C)[C@]([C@@]([C@@H](CC3)O)(CO)C)([H])CCC2=C)=CCO1
MCULE-4729556109 0.62 C(C#N)(C(OCC)=O)=C1CCCC(C)C1
MCULE-8003373034 0.62 C(C#N)(C(OCC)=O)=C1CCCCC1C
MCULE-3090499793 0.62 C1C[C@@]2(C)[C@@](CCC3C(=O)OCC=3)([H])C(=C)CC[C@]2([H])[C@](C)(CO)[C@@H]1O
MCULE-6246344331 0.62 C(C(=O)OCC)=CC=CCCCCC
MCULE-3246144635 0.62 O=C(CCC=C(CCC=C(CC/C=C(\C)/C)C)C)OCC=C(CC/C=C(\C)/C)C
MCULE-9320966507 0.62 C/C(=C\CC/C(=C/CC/C(=C/CCC(=O)OC/C=C(/CC/C=C(\C)/C)\C)/C)/C)/C
MCULE-3780130067 0.62 C(C#N)(C(=O)OCC)=C(CC)CCCC
MCULE-1618777000 0.62 CCOC(/C(/C)=C1\CCC(F)(F)CC\1)=O
MCULE-2585190354 0.62 [C@]12(C)CC[C@]3([C@@]([H])(CC[C@@]4([H])C[C@H](CC[C@]34C)OC(C)=O)[C@]1([H])CCC2=C(COC(C)=O)C#N)[H]
MCULE-9705119087 0.62 [H][C@@]12CCC(C)=CCCC(C)=C[C@@]1([H])OC(=O)C2
MCULE-7048270500 0.62 C1CC2(C)CC3OC(=O)C(C)=C3CC2C(=C)C1O
MCULE-7470354104 0.62 C(=C(/C)\C=C\CC(C)CCCC(C)C)/C(OCC)=O
MCULE-3963813373 0.62 C/C(=C\CCC(=CCOC)C)/C
MCULE-4484158013 0.62 C(=C(C)C=CCC(C)CCCC(C)C)C(OCC)=O
MolPort-044-545-969 0.62 C[C@H]1[C@@H]2CCC(C)=C[C@@H]2OC1=O
MolPort-001-742-639 0.62 C[C@@]1(CO)C(O)CC[C@@]2(C)[C@H](CCC3=CCOC3=O)C(=C)CC[C@H]12
MolPort-003-933-827 0.62 CCOC(=O)\C=C(/C)\C=C\C[C@@H](C)CCCC(C)C
MolPort-002-709-800 0.62 CCOC(=O)\C=C(/C)\C=C\CC(C)CCCC(C)C
MolPort-001-739-842 0.62 CC1=C2CC3C(=C)C(O)CCC3(C)CC2OC1=O
MolPort-006-109-235 0.62 CC(C)=CCC\C(C)=C\CC\C(C)=C\CCC(=O)OC\C=C(/C)CCC=C(C)C
MolPort-003-935-155 0.62 CCCCC\C=C/C=C/C(=O)OCC
MolPort-003-960-198 0.62 CC(C)=CCOC(C)=O
MolPort-044-723-779 0.62 CC(C)=CCCC(C)=CCCC(C)=CCCC(=O)OCC=C(C)CCC=C(C)C
MolPort-002-918-374 0.62 CC(C)(C)OC(=O)C(=C\C1CCCCC1)\C#N
MolPort-016-729-213 0.62 CCOC(=O)C(C#N)=C(C)C1CCCCC1
MolPort-005-944-410 0.62 CC(O)C(O)CCCCC1=C(C)C(=O)OC1
MolPort-001-763-338 0.62 CCOC(=O)C(C#N)=C1CCCCCC1
MolPort-002-898-232 0.62 CCOC(=O)C(C#N)=C1C2CC3CC(C2)CC1C3
MolPort-046-593-526 0.62 CCCCCCCCC\C=C\C=C\C=C\C=C\C=C\C(=O)OCC
MolPort-027-853-729 0.62 CC1=C2CC3C(=C)CCCC3(C)CC2OC1=O
MolPort-035-705-917 0.62 CC1(C)CCC[C@]2(C)[C@@H](CCC3=CC(=O)OC3)C(=C)CC[C@@H]12
MolPort-035-831-585 0.62 CCOC(=O)C=C(C)C(C)=O
MolPort-027-636-968 0.62 CCOC(=O)\C=C\CC
MolPort-046-702-138 0.62 CC1(CO)C(O)CCC2(C)C(CCC3=CCOC3=O)C(=C)CCC12
MolPort-020-005-706 0.62 C[C@@]1(CO)[C@H](O)CC[C@@]2(C)[C@H](CCC3=CCOC3=O)C(=C)CC[C@H]12
MolPort-019-910-198 0.62 CCOC(=O)\C=C\C(C)C
MolPort-023-220-734 0.62 CC1=C2C[C@H]3C(=C)CCC[C@]3(C)C[C@@H]2OC1=O
MCULE-8785798599 0.61 C1(CC2CC1C(C2(C)C)C)=C(C#N)C(OCC)=O
MCULE-5774659854 0.61 C1(CCC2C3C([C@]4(CCCCC4CC3)C)CC[C@]12C)=C(C#N)C(OCC)=O
MCULE-3260312658 0.61 C1(=CC(=O)OC(C)(C)C#C)C2CCC(C2(C)C)(C)C1=O
MCULE-2551313783 0.61 C1(CC2C(C)(C)C1(C)CC2)=C(C#N)C(OCC)=O
MCULE-8707630807 0.61 C(OCC)(OCC)C=C(C)CC/C=C(/C)\C
MCULE-5561830636 0.61 C1(=O)C=CC(CCCCCCCCCCCCC)O1
MCULE-6024774190 0.61 C1C(=O)OC(CCCCCC(CC)(O)C)C=1
MCULE-9797478674 0.61 C1C(=O)OC(CCCCCC(C(O)C)C)C=1
MCULE-5752112400 0.61 COC(C=CC1OCCCC1)=O
MCULE-1227063444 0.61 CCCC=CC(=O)OC
MCULE-5440757168 0.61 O=C(/C=C1/CC/1)OCC
MCULE-5397880976 0.61 CCCCCCCCCC=CC(O)=O
MCULE-1309002877 0.61 C(CCC=CC(=O)O)CCCCCCCCCC
MCULE-5063564829 0.61 [H]C(CCCCCC)=C([H])C(O)=O
MCULE-4145879256 0.61 C(OC)(=O)C=CCC(C)C
MCULE-6530848078 0.61 C1C[C@@]2(C)C(CCC(=C)[C@@H]2CC/C(=C/C(OC)=O)/C)[C@](C(O)=O)(C)C1
MCULE-9647932676 0.61 C(=C1/CCCCC/1)(\C#N)/C(OCC)=O
MCULE-8067531107 0.61 C1(C(C)(C)CCCC=1C)C=CC(C)=CC=CC(C)=CCOC(CC)=O
MCULE-4498603332 0.61 C(C)(=O)OC1CCC2(C)C3CCC4(C)C(=CCC4C3CC=C2C1)C(C)(OC(C)=O)[H]
MCULE-3752800864 0.61 CC1C(=O)CCC(C(OCC2[C@H]3C(C)(C)[C@H](C3)CC=2)=O)C1
MCULE-2337967762 0.61 [C@]12(C)CCC3C(CCC4=CC(OC(C)=O)CC[C@]34C)C1CC[C@]2(OC(C)=O)C(C)OC(C)=O
MCULE-9952768892 0.61 C1(=O)CC2C(C(=C1)COC(=O)C)(C)CCC(C)C2(CCC(CC(O)=O)C)C
MCULE-7772391429 0.61 [C@]12(C)CCC3[C@@]([H])(CCC4=CC(OC(C)=O)CC[C@]34C)C1CC[C@]12CCC(=O)O1
MCULE-7170821286 0.61 C(C)(=O)OC1CCC2(C)C3CCC4(C)C(=CCOC(C)=O)CCC4C3CC=C2C1
MolPort-009-019-065 0.61 CCCCCCCCCCCCCCCCC\C=C/C(O)=O
MolPort-001-783-818 0.61 CCCCCC\C=C\C(O)=O
MolPort-003-662-504 0.61 CCCCCCC\C=C\C(O)=O
MolPort-009-019-139 0.61 CC(C)CCCCCCC\C=C/C(O)=O
MolPort-027-641-532 0.61 CCCCCCCCCCCCC\C=C/C(O)=O
MolPort-009-019-066 0.61 CCCCCCCCCCCCCCCCC\C=C\C(O)=O
MolPort-000-157-303 0.61 COC(=O)\C=C\CC(C)C
MolPort-003-896-116 0.61 CCC\C=C\C(=O)OC
MolPort-003-987-050 0.61 CCCCCCCCCCCCC\C=C\C(O)=O
MolPort-002-486-877 0.61 COC(=O)C(C(=O)OC)=C1C2CC3CC(C2)CC1C3
MolPort-001-740-480 0.61 COC(=O)\C=C(/C)CC[C@H]1C(=C)CCC2[C@]1(C)CCC[C@]2(C)C(O)=O
MolPort-003-939-552 0.61 CCC(=O)OC\C=C(/C)\C=C\C=C(/C)\C=C\C1=C(C)CCCC1(C)C
MolPort-001-783-662 0.61 CCOC(=O)C(C#N)=C1CCCCC1
MolPort-006-113-476 0.61 CCOC(=O)C1=CCCCC1
MolPort-002-525-199 0.61 CC(=O)OC1CC[C@]2(C)C3CC[C@@]4(C)C(CC[C@@]44CCC(=O)O4)[C@@H]3CCC2=C1
MolPort-001-742-676 0.61 CC(CCC1(C)C(C)CCC2(C)C1CC(=O)C=C2COC(C)=O)CC(O)=O
MolPort-002-527-934 0.61 CC(OC(C)=O)[C@]1(CC[C@H]2[C@@H]3CCC4=C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OC(C)=O)OC(C)=O
MolPort-001-781-851 0.61 CCCCCCCCC\C=C\C(O)=O
MolPort-002-536-815 0.61 CCOC(=O)C(\C#N)=C1/CC2CC1C(C)C2(C)C
MolPort-006-116-189 0.61 CCCCCCCCCC=CC(O)=O
MolPort-001-769-791 0.61 COC(=O)\C=C/CC(C)C
MolPort-023-221-985 0.61 CCCCCCCC\C=C\C(O)=O
MolPort-028-601-434 0.61 CCCCCCC\C=C/C(O)=O
MolPort-035-677-529 0.61 CCOC(=O)C=C1CC1
MolPort-019-997-373 0.61 CCCCCCCCC\C=C/C(O)=O
MolPort-046-597-757 0.61 CC(OC(C)=O)[C@]1(CCC2C3CCC4=CC(CC[C@]4(C)C3CC[C@]12C)OC(C)=O)OC(C)=O
MolPort-046-690-008 0.61 CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4[C@H](OC(C)=O)[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
MolPort-027-935-414 0.61 CC1CC(CCC1=O)C(=O)OCC1=CC[C@H]2C[C@@H]1C2(C)C
MolPort-023-274-376 0.61 CC(O)C(C)CCCCCC1OC(=O)C=C1
MolPort-023-274-302 0.61 CCC(C)(O)CCCCCC1OC(=O)C=C1
MolPort-028-854-619 0.61 CCOC(=O)C(\C#N)=C1\CCC2[C@@H]3CCC4CCCC[C@]4(C)[C@H]3CC[C@]12C
MolPort-002-508-307 0.61 CCOC(=O)C(\C#N)=C1\CCC2C3CCC4CCCC[C@]4(C)C3CC[C@]12C
MolPort-046-683-408 0.61 C.CCCCCCC\C=C\C(O)=O
MolPort-000-829-002 0.61 CCOC(=O)C(\C#N)=C1\CC2CCC1(C)C2(C)C
MolPort-003-959-986 0.61 CCOC(OCC)\C=C(/C)CCC=C(C)C
MCULE-5004523631 0.60 C(OCC1CCC1)(=O)C([H])=C([H])C1CCC1
MCULE-3654721932 0.60 C12C3C4C5C1C(C1C5C(C4CC3=CC(OCC)=O)CC1=CC(=O)OCC)C1OC21
MCULE-1014190195 0.60 C1(OCC(=C1C)CCCCC(=O)O)=O
MCULE-1216188840 0.60 C(C)(=O)OC1CCC2(C)C3CCC4(C)C(C(C)CCCC(C)C)CCC4C3CC(C2=C1)=O
MCULE-5530658305 0.60 O1C(C)CCC(O)C=CC(=O)OC(C)CCC(O)C=CC1=O
MCULE-4827454681 0.60 O=C1CCC2(C)C3CCC4(C)C(CCC4C3CC(C2=C1)OC(C)=O)C(C)=O
MCULE-9817372120 0.60 O=C1CCC2(C)C3CCC4(C)C(CCC4C3CC(C2=C1)OC(C)=O)=O
MCULE-5943290394 0.60 C1(=O)C=C[C@@H](O)CC[C@@H](C)OC(C=C[C@@H](O)CC[C@@H](C)O1)=O
MCULE-7410726907 0.60 C1(C(C)(C)CCCC=1C)C=CC(C)=CC=CC(C)=CC(=O)OC(=O)C=C(C)C=CC=C(C)C=CC1C(C)(C)CCCC=1C
MCULE-1819290201 0.60 [C@]12(C)CCC3[C@@]([H])(CCC4=C[C@@H](OC(C)=O)CC[C@]34C)C1CC[C@@]2(C(C)=O)OC(C)=O
MCULE-3112926488 0.60 C(=C(C)C=CCCCCC)C(OCC)=O
MCULE-7551190404 0.60 C(=C(/C)\C=C\CCCCC)/C(OCC)=O
MCULE-2250014562 0.60 CCC1C(=CC(O)=O)CCCCC1
MCULE-7476214558 0.60 COC(/C=C1\CCC\1)=O
MCULE-9881433750 0.60 CC(CC1CCCCC1)=CC(O)=O
MCULE-6657971505 0.60 CC1(C(=CC(O)=O)CCCC1)C
MCULE-3408838682 0.60 O=C(/C=C/C1CCCCC1)O
MCULE-7029387078 0.60 CC(=O)C=CC(=O)OCC
MCULE-4260624829 0.60 CC(CC1CCCC1)=CC(O)=O
MCULE-6492056036 0.60 OC(C=CC1C2CC3CC(C2)CC1C3)=O
MCULE-1521149204 0.60 CC(C1CCCCC1)=CC(O)=O
MCULE-4284204201 0.60 OC(C=CC1CCCCC1)=O
MCULE-2410110547 0.60 CC1C(=CC(O)=O)CCCCC1
MCULE-5583031618 0.60 CC1(CC/C(=C/C(O)=O)/CC1)C
MCULE-3636319201 0.60 OC(C=CC1C2CCC(CC2)C1)=O
MCULE-3542266412 0.60 CC(C1C(=CC(O)=O)CCCCC1)C
MolPort-044-561-641 0.60 CCCCCCCC\C=C/CCOC(=O)\C=C\C
MolPort-005-945-282 0.60 CC(=O)OC\C(CC[C@@H]1C(CO)=CC[C@@H]2C(C)(C)CCC[C@@]12C)=C\C(O)=O