SANC01026 2-Methyl-6-(3-methyl-2-butenyl)benzo-1,4-quinone



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Analog ID Similarity score SMILES

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Mcule | MolPort | All | None
MCULE-9976634952 0.95 C12CC(=C(C)CC=1C(=O)C1CC(C)=C(C)CC=1C2=O)C
MCULE-8288730380 0.90 C1C(=O)C2C3CCC(C(C)=C3)C=2C(=O)C=1
MCULE-5877894053 0.89 C(C)(C)(CC)C1C(C=C(C(C=1)=O)C(CC)(C)C)=O
MolPort-003-891-724 0.89 CCC(C)(C)C1=CC(=O)C(=CC1=O)C(C)(C)CC
MCULE-9625917775 0.87 C1(CCCC2=CC(C=CC2=O)=O)=CC(C(C)=CC1=O)=O
MolPort-002-915-854 0.87 CC1=CC(=O)C(CCCC2=CC(=O)C=CC2=O)=CC1=O
MCULE-3533996454 0.86 C(=CC(CCC=C)=O)C1C(C)(C)CCC=C1C
MCULE-6490731029 0.86 C1(CC)=CC(C=C(CC)C1=O)=O
MCULE-5817153512 0.86 C1(=O)C(C(C)C)=CC(=O)C=C1C(C)C
MCULE-5214801115 0.86 C1(C(C)(C)C)=CC(=O)C=C(C(C)(C)C)C1=O
MCULE-5433016497 0.86 C1(C(C)(C)C)C(=O)C=C(C(=O)C=1)C(C)(C)C
MCULE-8682863565 0.86 C1(C(C)(C)C)C(=O)C=CC(=O)C=1
MCULE-5207883585 0.86 C1(C(C)(C)C)C(=O)C=C(C(=O)C=1)C
MCULE-9899033250 0.86 C1(=O)C(C)=CC(=O)C(C(C)C)=C1
MolPort-001-766-682 0.86 CC1=CCCC(C)(C)C1\C=C\C(=O)CCC=C
MolPort-000-141-928 0.86 CC(C)(C)C1=CC(=O)C=C(C1=O)C(C)(C)C
MolPort-002-904-388 0.86 CCC1=CC(=O)C=C(CC)C1=O
MolPort-001-779-768 0.86 CC(C)C1=CC(=O)C(C)=CC1=O
MolPort-003-932-638 0.86 CC(C)(C)C1=CC(=O)C=CC1=O
MolPort-000-861-080 0.86 CC(C)(C)C1=CC(=O)C(=CC1=O)C(C)(C)C
MolPort-001-817-082 0.86 CC1=CC(=O)C(=CC1=O)C(C)(C)C
MolPort-023-279-166 0.86 CC(C)C1=CC(=O)C=C(C(C)C)C1=O
MCULE-2395006256 0.85 O=C1C=C[C@@]2(C)C(C(C[C@@]3([C@@]2(CC[C@@]2(C)[C@]3(CCC2=O)[H])[H])[H])=O)=C1
MCULE-1863648617 0.85 C1[C@@]2(C)C(C(=O)C[C@@H]3[C@@H]2CC[C@@]2(C)[C@H]3CCC2=O)=CC(=O)C=1
MolPort-028-750-136 0.85 C[C@]12CC[C@H]3[C@@H](CC(=O)C4=CC(=O)C=C[C@]34C)[C@@H]1CCC2=O
MCULE-2300065923 0.84 C1(CCCCCCC2=CC(C=CC2=O)=O)=CC(C=CC1=O)=O
MCULE-9582195314 0.84 C1(CCCCCC2=CC(C(C)=CC2=O)=O)=CC(C(C)=CC1=O)=O
MCULE-3468058170 0.84 C1(CCCCCCC2=CC(C(C)=CC2=O)=O)=CC(C(C)=CC1=O)=O
MCULE-8485600766 0.84 O=C1C(C(C)(C)CC(C)(C)C)=CC(C(C(CC(C)(C)C)(C)C)=C1)=O
MCULE-6987941164 0.84 C1(C(C)(C)C)=CC2(CCCC2)C=C(C(C)(C)C)C1=O
MCULE-1076344451 0.84 [C@]12(C)C(=O)C=C[C@@]1(C)C=CC2=O
MCULE-8076747851 0.84 O=C1C(C)(CC=C)C(C)C=C1CC=C
MolPort-002-915-935 0.84 CC1=CC(=O)C(CCCCCC2=CC(=O)C(C)=CC2=O)=CC1=O
MolPort-002-915-848 0.84 O=C1C=CC(=O)C(CCCCCCC2=CC(=O)C=CC2=O)=C1
MolPort-002-915-936 0.84 CC1=CC(=O)C(CCCCCCC2=CC(=O)C(C)=CC2=O)=CC1=O
MolPort-002-549-449 0.84 CC(C)(C)C1=CC2(CCCC2)C=C(C1=O)C(C)(C)C
MolPort-002-894-025 0.84 C[C@]12C=CC(=O)[C@@]1(C)C(=O)C=C2
MCULE-3036443253 0.83 O=C1C(C)=C(C)C(CCC2(C)C(C)=C(C)C(C(C)=C2C)=O)(C)C(C)=C1C
MCULE-4464721001 0.81 C12C(=O)C=CC(=O)C=1C1C3C=CC3C2C=C1
MCULE-2259130970 0.81 C1(C(C)(C)C)=CC2(CC2)C=C(C(C)(C)C)C1=O
MCULE-7093893764 0.81 C1=CC2C3C(C)([H])C4C(=O)C=CC(=O)C4C(C)([H])C=3C1C2
MolPort-002-549-671 0.81 CC(C)(C)C1=CC2(CC2)C=C(C1=O)C(C)(C)C
MCULE-7363650943 0.80 O=C1C=CC2(C)C3C(CC4(C)C(CCC4C3CCC2=C1)=O)=O
MCULE-3225619905 0.80 C1(C(=O)C=CC(=O)C=1)C[C@]1(C)[C@@H](C)CC[C@]2(C)C(=CCC[C@@H]12)C
MolPort-002-879-590 0.80 CC1=CC(=O)C2CC1C(C)=CC2=O
MCULE-8490201471 0.79 C1(CC=CCC)C(=O)CCC=1C
MCULE-2459463798 0.79 C1(C/C=C\CC)C(=O)CCC=1C
MCULE-1952094862 0.79 O=C1CCC(C)=C1C/C=C/CC
MolPort-001-834-902 0.79 O=C1C(CCCC1=C1CCCCC1)=C1CCCCC1
MolPort-003-929-044 0.79 CC\C=C/CC1=C(C)CCC1=O
MolPort-006-111-428 0.79 CCC=CCC1=C(C)CCC1=O
MolPort-002-514-318 0.79 CC\C=C\CC1=C(C)CCC1=O
MCULE-6918609415 0.78 C1(C(C)(C)CCCC=1C)CC=C(C)C=O
MCULE-7072600101 0.78 C1(C(C)=CCCC1(C)C)C=C(C)C(=O)C
MCULE-1426909577 0.78 C1(=O)C[C@@]2([H])[C@H](C)CC(=O)/C(=C(\C)/C)/[C@@]2([H])C=C1C
MCULE-4203969651 0.78 C1(=CC(C(C)=CC1=O)=O)CCC1=CC(C(C)=CC1=O)=O
MCULE-8302753934 0.78 C1(=CC(C=CC1=O)=O)CCC1=CC(C=CC1=O)=O
MolPort-002-894-037 0.78 CC1=CC(=O)C(CCC2=CC(=O)C(C)=CC2=O)=CC1=O
MolPort-000-145-914 0.78 CC(=O)C(\C)=C\C1C(C)=CCCC1(C)C
MolPort-002-915-849 0.78 O=C1C=CC(=O)C(CCC2=CC(=O)C=CC2=O)=C1
MolPort-001-740-071 0.78 C[C@]12CCC3[C@@H](CCC4=CC(=O)C=C[C@]34C)C1CCC2=O
MolPort-002-690-624 0.78 C[C@@H]1CC2C3CCC4=CC(=O)C=CC4(C)C3CCC2(C)[C@@]1(C)C(C)=O
MolPort-002-524-060 0.78 C[C@@H]1CC2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)C3CC[C@]2(C)[C@@]1(C)C(C)=O
MolPort-003-666-031 0.78 C[C@]12CCC3C(CCC4=CC(=O)C=C[C@]34C)C1CCC2=O
MolPort-000-739-273 0.78 CC12CCC3C(CCC4=CC(=O)C=CC34C)C1CCC2=O
MolPort-002-506-962 0.78 C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1CCC2=O
MolPort-002-511-910 0.78 C\C(C=O)=C\CC1=C(C)CCCC1(C)C
MolPort-000-830-001 0.78 C\C(C=O)=C/CC1=C(C)CCCC1(C)C
MolPort-046-196-627 0.78 CC(=O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@H]3CC[C@]12C
MolPort-035-706-199 0.78 C[C@@H]1CC(=O)C([C@H]2C=C(C)C(=O)C[C@@H]12)=C(C)C
MCULE-3980671232 0.77 C12(C)CCC3C(CCC4=CC(=O)C=CC34C)C1CC(C)C2(C)C(C)=O
MCULE-1263670923 0.77 O=C1C2CCCCC=2C2(CCCC2)C2CCCCC=21
MCULE-2836304314 0.77 [C@]12(C)C=CC(C=C1CC[C@]1([H])[C@]2([H])CC[C@]2([C@@]1([H])CCC2=O)C)=O
MCULE-7782959791 0.77 C12(C)CCC3C(CCC4=CC(=O)C=CC34C)C1C[C@@H](C)[C@]2(C)C(C)=O
MCULE-9344488087 0.77 C12(C)C=CC(C=C1CCC1C2CCC2(C1CCC2=O)C)=O
MCULE-4904757465 0.77 C1(CCC(=O)C)C(C)CC(=O)/C(=C(\C)/C)/CC=1
MCULE-6393727075 0.77 C12C[C@@H](CC[C@@]1(C)C=CC(=O)C=2C)C(C)=C
MolPort-039-338-609 0.77 CC1CC(=O)C(CC=C1CCC(C)=O)=C(C)C
MCULE-4768757628 0.76 CC1CC2C(=C3C(C4C(=O)C(=O)C=42)CC(C)CC3)CC1
MolPort-000-719-686 0.76 CC(=O)\C=C\C1C(C)=CCCC1(C)C
MolPort-004-288-323 0.76 CC(=O)C=CC1C(C)=CCCC1(C)C
MCULE-5288068491 0.75 C1(=O)C(C)(C)C(=O)C=CC(=O)C(C)(C)C(=O)C=CC(=O)C(C)(C)C(=O)C=CC(=O)C(C)(C)C(=O)C=CC(=O)C(C)(C)C(=O)C=CC(=O)C(C)(C)C(=O)C=C1
MCULE-1551509118 0.75 O=C1C=CC(C(C)(C)C(C=CC(C(C)(C)C(C=CC(C(C)(C)C(C=CC(C1(C)C)=O)=O)=O)=O)=O)=O)=O
MCULE-6264302119 0.75 C1(=O)C(CC)(CC)C(=O)C=CC(C(C)(C)C(=O)C=CC(=O)C(CC)(CC)C(=O)C=CC(C(C)(C)C(=O)C=C1)=O)=O
MCULE-6489078705 0.74 C1CC2([H])C(=O)C=CC(=O)C2([H])CC=1
MCULE-6957386653 0.74 O=C1C(C)=C(C)C(C)(C)C(C)=C1C
MCULE-4487129132 0.74 C1(C)=CC(=O)C=C(C)C1=O
MCULE-3778053676 0.74 C1(=O)C=CCCCC=C1
MCULE-4663973266 0.74 C1(C)C(=O)C(C)=C(C(=O)C=1C)C
MCULE-3357025005 0.74 C1(C)C(=O)C(C)=CC(=O)C=1C
MolPort-002-507-391 0.74 C\C=C\C(=O)C1=C(C)CCCC1(C)C
MolPort-003-940-973 0.74 CC1=CC(=O)C=C(C)C1=O
MolPort-001-561-429 0.74 CC1=CC(=O)C(C)=C(C)C1=O
MolPort-001-779-967 0.74 CC1=C(C)C(=O)C(C)=C(C)C1=O
MCULE-5070166283 0.73 C1(C2(CCCC2)C(=O)C=CC(C2(CCCC2)C(=O)C=CC(C2(CCCC2)C(=O)C=CC(C2(CCCC2)C(=O)C=C1)=O)=O)=O)=O
MCULE-2256614888 0.73 C1(=O)C(C)(C)C(=O)C=CC(C2(CCCCC2)C(=O)C=CC(=O)C(C)(C)C(=O)C=CC(C2(CCCCC2)C(=O)C=C1)=O)=O
MCULE-4042007732 0.73 C1(C2(CCCCC2)C(=O)C=CC(C2(CCCCC2)C(=O)C=CC(C2(CCCCC2)C(=O)C=CC(C2(CCCCC2)C(=O)C=C1)=O)=O)=O)=O
MCULE-1201927354 0.73 C1(C(CC)(CC)C(=O)C=CC(C2(CCCCC2)C(=O)C=CC(C(CC)(CC)C(=O)C=CC(C2(CCCCC2)C(=O)C=C1)=O)=O)=O)=O
MolPort-046-589-601 0.73 CC(=O)C1=CC[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)C3=CC[C@]12C
MolPort-035-705-911 0.73 CC(=O)\C=C\[C@H]1C(=C)CC[C@H]2C(C)(C)CCC[C@]12C
MolPort-046-765-581 0.73 C[C@]12CC(=O)[C@@H]3[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@H]1CC=C2C(=O)C=O
MCULE-3530749400 0.71 C1C(=O)C(C)=CC(=O)C=1C
MCULE-9650878933 0.71 C1(C)C(=O)C=CC(=O)C=1
MCULE-8961312077 0.71 C(CC(C)CC(C)(C)C)=CC(CC(C)C)=O
MCULE-7669056375 0.71 C1(C)C(=O)C=CC(=O)C=1C
MCULE-6776633195 0.71 C/C(=C1\C(=O)CC(C)=CCCC(C)=CC\1)/C
MCULE-6153734702 0.71 C1C(C)=CC/C(=C(/C)\C)/C(=O)CC(C)=CC1
MCULE-7573937296 0.71 C/C(=C1/C(=O)CC(C)=CCCC(C)=CC/1)/C
MolPort-020-005-710 0.71 CC(C)=C1C\C=C(C)\CC\C=C(C)\CC1=O
MolPort-001-787-708 0.71 CC1=CC(=O)C(C)=CC1=O
MolPort-001-559-210 0.71 CC1=CC(=O)C=CC1=O
MolPort-002-537-951 0.71 CC(C)CC(=O)\C=C\CC(C)CC(C)(C)C
MolPort-039-144-999 0.71 CC(C)=C1C\C=C(C)\CCC=C(C)CC1=O
MolPort-020-172-332 0.71 CC1=C(C)C(=O)C=CC1=O
MolPort-046-762-450 0.71 CC(C)=C1C\C=C(C)\CC\C=C(C)/CC1=O
MolPort-039-052-323 0.71 CC(C)=C1C\C=C(C)/CC\C=C(C)/CC1=O
MCULE-8716463141 0.70 C1(C)(C)CC=C(C)CCC=C(C)C(=O)C=C1
MCULE-4547070816 0.70 C1(=O)C(C)(C)C(=O)CCC(=O)C(C)(C)C(=O)C=CC(=O)C(C)(C)C(=O)CCC(=O)C(C)(C)C(=O)C=C1
MolPort-019-939-283 0.70 C\C1=C/CC(C)(C)\C=C\C(=O)\C(C)=C\CC1
MolPort-044-561-264 0.70 C\C1=C/CC(C)(C)\C=C\C(=O)\C(C)=C/CC1
MCULE-6729235185 0.69 C1(C)(C)C(CC=CC(=O)CC)CC=C1C
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MCULE-6900112057 0.69 C1CCCC2C(=O)CC(C)C=2CCCCCC1
MCULE-2031804178 0.69 C1(CCC(C)=O)=C(C)CCC1C(C)=C
MCULE-3333037285 0.69 C1(C(C)(C)C)=CC(=C)C=C(C(C)(C)C)C1=O
MCULE-4240902847 0.69 C1(=CC2CCCCC2)C(=O)C(=CC2CCCCC2)CC1
MolPort-038-900-529 0.69 C=CC(=O)C1=CCCC1
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MolPort-019-879-284 0.69 CC(C)(C)C1=CC(=C)C=C(C1=O)C(C)(C)C
MolPort-042-665-810 0.69 CC(=O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C=C)[C@H]3CC[C@]12C
MCULE-7494382495 0.68 C1(C(C)C=CCC1(C)C)C(=O)C=CC
MCULE-9392152255 0.68 CC1C(=O)C(C)=C(C)C1C
MCULE-3588728893 0.68 C1(C)C(=O)C(C)=C(CC[C@](C)(O)CCC[C@H](C)CCC[C@H](C)CCCC(C)C)C(=O)C=1C
MCULE-9439225491 0.68 CC1C(=O)C(C)=C(CC[C@](O)(CCC[C@@H](CCC[C@@H](CCCC(C)C)C)C)C)C(=O)C=1C
MCULE-5632142516 0.68 C(C(CCC=C(C)CC/C=C(\C)/C)=O)=CC(C)C
MCULE-9092365556 0.68 C(=O)C(CCCC)=CCCCCC
MCULE-7619150531 0.68 CCCCC/C=C(\C=O)/CCCC
MolPort-023-220-687 0.68 CC(C)CCC[C@@H](C)CCC[C@@H](C)CCC[C@@](C)(O)CCC1=C(C)C(=O)C(C)=C(C)C1=O
MolPort-000-733-785 0.68 CC(C)\C=C\C(=O)CC\C=C(/C)CCC=C(C)C
MolPort-006-118-882 0.68 CC(C)CCCC(C)CCCC(C)CCCC(C)(O)CCC1=C(C)C(=O)C(C)=C(C)C1=O
MolPort-004-831-228 0.68 C\C=C\C(=O)C1C(C)C=CCC1(C)C
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MCULE-2093338891 0.67 C1(=O)/C(=C2\CCCC\2)/CC/C/1=C1\CCCC\1
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MCULE-9696156059 0.67 C12CC(C3C(=O)C=CC(=O)C13)C1=C2C2CC1CC2
MCULE-1445062394 0.67 C12(C)CC(C3C(C=CC(=O)C31)=O)C(C)=C2
MCULE-6858813637 0.67 C1=CC2CC1C1C(=O)C=CC(=O)C21
MCULE-1981040221 0.67 C1CC2C3C(C)([H])C4C(=O)C=CC(=O)C4C(C)([H])C=3C1C2
MCULE-8371261917 0.67 CC1C(=O)C2C(C3C=CC2C3)C(=O)C=1
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MCULE-5887629699 0.67 C1=C[C@]2(C(=CC1=O)CC[C@@]1([H])[C@]3([H])CC[C@]([H])(C(=O)O)[C@]3(CC([C@]21[H])=O)C)C
MCULE-6930955162 0.67 C1(CCCCC)C(=O)CCC=1C
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MCULE-4315440442 0.67 C1C[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@H]([C@@H](/C=C/[C@@H](CC)C(=C)C)C)CC[C@@]4([H])[C@]3([H])CCC2=CC1=O
MCULE-2807643168 0.67 C1(C)CC(=O)C=C1CCCCC
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MolPort-046-793-097 0.67 CC(=O)[C@H]1CC=C2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
MolPort-020-006-184 0.67 CC(C)(C)C1=CC(C)(O)C=C(C1=O)C(C)(C)C
MolPort-003-925-033 0.67 CCCCCC1=C(C)CCC1=O
MolPort-000-837-794 0.67 CCCCCCC1=CCCC1=O
MolPort-001-790-818 0.67 CCCCCC1=CCCC1=O
MolPort-005-945-021 0.67 CC\C=C\CC1=C(CCCCCCCC(O)=O)CCC1=O
MolPort-003-179-188 0.67 CC1=CC2(C)CC1C1C2C(=O)C=CC1=O
MCULE-2576853438 0.67 C1C(=O)C=CC(=O)C=1
MCULE-2603291254 0.66 [C@]12(C)CC(=O)[C@]3([C@@]([H])(CCC4=CC(=O)C=C[C@]34C)[C@]1([H])CC[C@]2(O)C(CO)=O)[H]
MCULE-9427838644 0.66 C12(C)CC(=O)C3C(CCC4=CC(=O)C=CC34C)C1CCC2(O)C(CO)=O
MCULE-4729751323 0.66 C[C@@H]1[C@@](C(CO)=O)(O)[C@]2(C)[C@H]([C@H]3[C@H](C(C2)=O)[C@]2(C)C(=CC(C=C2)=O)CC3)C1
MCULE-3352767740 0.66 C1(CCCCCCC2=CC(C(Br)=CC2=O)=O)=CC(C(Br)=CC1=O)=O
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