SANC00221 (R)-Scillascillin




Analog ID Similarity score SMILES

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Mcule | MolPort | All | None
MolPort-029-887-060 1 OC1=CC2=C(C(O)=C1)C(=O)[C@@]1(CC3=C1C=C1OCOC1=C3)CO2
MCULE-2982479295 1 C1(O)C=C2OC[C@@]3(C4C=C5OCOC5=CC=4C3)C(=O)C2=C(O)C=1
MCULE-3341716045 0.96 C1(OC)C=C2OC(O)[C@@]3(C4C=C5OCOC5=CC=4C3)C(=O)C2=C(O)C=1
MolPort-035-705-986 0.96 COC1=CC2=C(C(O)=C1)C(=O)[C@@]1(CC3=C1C=C1OCOC1=C3)C(O)O2
MolPort-020-005-879 0.82 CC1=C(O)C2=C(OC[C@@H](CC3=CC=C4OCOC4=C3)C2=O)C(C)=C1O
MolPort-027-720-889 0.82 CC1=C(O)C(C)=C2OCC(CC3=CC=C4OCOC4=C3)C(=O)C2=C1O
MCULE-8753334659 0.82 C1(O)C(C)=C2OC[C@@H](CC3C=CC4OCOC=4C=3)C(=O)C2=C(O)C=1C
MCULE-5082193272 0.82 O1C2=C(C)C(=C(C)C(=C2C(C(C1)CC1=CC=C2C(=C1)OCO2)=O)O)O
MolPort-039-339-057 0.81 CC1=C2OC[C@@H](CC3=CC4=C(OCO4)C=C3)C(=O)C2=C(O)C(C=O)=C1O
MCULE-1782797624 0.81 C1(O)C(C)=C2OC[C@@H](CC3C=CC4OCOC=4C=3)C(=O)C2=C(O)C=1C=O
MolPort-046-508-982 0.75 COC1=C(O)C=CC(C2COC3=CC(O)=CC(O)=C3C2=O)=C1OC
MCULE-6373579877 0.75 C1(O)C=C2OCC(C3C=CC(O)=C(OC)C=3OC)C(=O)C2=C(O)C=1
MCULE-9748121668 0.74 O1C(C)C(C2C=CC3=C(C=2)OCCO3)C(C2C=C(CCC)C(OC)=CC1=2)=O
MCULE-2331262877 0.73 C1(COC2=C(C=CC(OC)=C2)C1=O)C1C(OC)=CC(=C(OC)C=1OC)OC
MCULE-2851603971 0.73 C1(O)C=C2OCC(CC3C=CC(OC)=C(O)C=3)C(=O)C2=C(O)C=1
MolPort-029-887-061 0.73 COC1=CC=C(CC2COC3=C(C(O)=CC(O)=C3)C2=O)C=C1O
MCULE-6744641772 0.72 C12C=CC(=C(C)C=1OCC(C1C=CC3=C(OCCO3)C=1)C2=O)OC
MCULE-9948220621 0.71 C12C=C(CCC)C(=CC=1OCC(C1C=CC3=C(OCCO3)C=1)C2=O)OC
MCULE-4719487645 0.71 C12C=C(CC)C(=CC=1OCC(C1C=CC3=C(OCCO3)C=1)C2=O)OC
MolPort-002-509-337 0.71 CCC1=CC2=C(OCC(C2=O)C2=CC3=C(OCCO3)C=C2)C=C1OC
MolPort-000-657-221 0.71 CCCC1=CC2=C(OCC(C2=O)C2=CC3=C(OCCO3)C=C2)C=C1OC
MolPort-038-942-141 0.70 OC1=CC=C(C=C1)C1COC2=C(C(O)=CC(O)=C2)C1=O
MolPort-035-706-506 0.70 OC1=CC2=C(C=C1)C(=O)C(CC1=CC(O)=C(O)C=C1)CO2
MCULE-4391957723 0.70 C1(O)C=C2OCC(CC3C=CC(O)=C(O)C=3)C(=O)C2=CC=1
MCULE-7026035805 0.70 C1(OC)C(O)=C2OCC(CC3C=CC(O)=CC=3)C(=O)C2=C(O)C=1
MCULE-2823268443 0.70 C1(=O)C(C2C=CC=CC=2)COC2C=C(OC)C=CC1=2
MCULE-3292535358 0.70 C12C=CC(OC)=CC=1OC[C@@H](C1=CC=C(OC)C=C1)C2=O
MCULE-3563693636 0.70 C1OC2=C(C=CC(O)=C2C)C(=O)C1C1=CC=C(O)C=C1
MolPort-035-705-989 0.70 COC1=C(O)C2=C(C(O)=C1)C(=O)C(CC1=CC=C(O)C=C1)CO2
MolPort-045-901-612 0.70 COC1=CC2=C(C=C1)C(=O)C(CO2)C1=CC=CC=C1
MolPort-046-693-674 0.70 COC1=CC=C(C=C1)[C@@H]1COC2=C(C=CC(OC)=C2)C1=O
MolPort-003-846-731 0.69 OC1=CC=C(C=C1)C1COC2=C(C=CC(O)=C2)C1=O
MolPort-013-264-378 0.69 O=C1CCOC2=C1C=C1OCOC1=C2
MolPort-035-700-574 0.69 CC1(C)CC(=O)C2=CC=C3OC(=O)CC(C4=CC5=C(OCO5)C=C4)C3=C2O1
MCULE-5855528622 0.69 C1(O)C=C2OCC(C3C=CC(O)=CC=3)C(=O)C2=CC=1
MCULE-1362087997 0.69 O=C1C2=C(C=C3C(=C2)OCO3)OCC1
MCULE-2739140364 0.69 C12=C(C=CC3C(CC(C)(C)OC1=3)=O)OC(CC2C1C=CC2=C(OCO2)C=1)=O
MCULE-1405836247 0.69 C1(O)C=C2OCC(C3C(O)=CC(O)=CC=3)C(=O)C2=C(O)C=1
MCULE-4060250781 0.69 C12O[C@@H](C(C)C)CC1=C1O[C@]3([H])COC4C(=CC(OC)=C(OC)C=4)[C@]3([H])C(=O)C1=CC=2
MCULE-2808039967 0.69 O1C2=CC(OC)=C(OC)C=C2C2(C(C3C(=C4CC(C(C)C)OC4=CC=3)OC2(C1)[H])=O)[H]
MolPort-039-141-920 0.69 OC1=CC(O)=C(C=C1)C1COC2=C(C(O)=CC(O)=C2)C1=O
MolPort-002-893-977 0.69 COC1=C(OC)C=C2[C@H]3[C@@H](COC2=C1)OC1=C(C=CC2=C1C[C@@H](O2)C(C)C)C3=O
MolPort-046-158-486 0.68 OC1=CC=C(C=C1)[C@H]1OC2=CC(O)=CC(O)=C2C(=O)[C@@H]1C1=C2O[C@@H](CC(=O)C2=C(O)C=C1O)C1=CC(O)=C(O)C=C1
MolPort-027-720-890 0.68 COC1=CC=C(C[C@@H]2COC3=C(C2=O)C(O)=C(C)C(O)=C3C)C=C1
MolPort-046-790-524 0.68 CC1=C(O)C=C2OC[C@@H](CC3=CC=C(O)C=C3)C(=O)C2=C1O
MCULE-6672284700 0.68 C1(O)C(C)=C2OC[C@@H](CC3C=CC(OC)=CC=3)C(=O)C2=C(O)C=1C
MCULE-2373585148 0.68 CC1C(O)=C(C)C2OCC(CC3C=CC(OC)=CC=3)C(=O)C=2C=1O
MCULE-2538844083 0.68 C1(O)C=C2OC(O)(C(=O)C2=C(O)C=1)CC1C=C(O)C(OC)=C(O)C=1
MCULE-3471863657 0.68 C1(=CC(OC)=C2C(OCO2)=C1OC)C(C(OC)OC)C(=O)C1=CC=C(C=C1)OC
MCULE-6745304759 0.68 C1C(O)=C2C(C(COC2=CC=1O)CC1C=CC(=CC=1)OC)=O
MCULE-2575175530 0.68 C1(O)C=C2OCC(C3C(OC)=CC(OC)=CC=3)C(=O)C2=C(O)C=1
MolPort-035-705-948 0.68 COC1=C(O)C=C(CC2(O)OC3=C(C2=O)C(O)=CC(O)=C3)C=C1O
MolPort-039-340-919 0.68 COC(OC)C(C(=O)C1=CC=C(OC)C=C1)C1=C(OC)C2=C(OCO2)C(OC)=C1
MolPort-019-937-209 0.68 COC1=CC=C(CC2COC3=CC(O)=CC(O)=C3C2=O)C=C1
MolPort-046-761-031 0.68 COC1=CC=C(C[C@@H]2COC3=CC(O)=CC(O)=C3C2=O)C=C1
MolPort-039-142-054 0.68 COC1=CC(OC)=C(C=C1)C1COC2=C(C(O)=CC(O)=C2)C1=O
MolPort-046-790-516 0.67 COC1=CC(O)=C2C(=O)C(CC3=CC=C(O)C=C3)COC2=C1
MolPort-035-800-591 0.67 COC1=C(OC)C=C2C3C(COC2=C1)OC1=C(C=CC2=C1CC(O2)C(C)=O)C3=O
MCULE-1533382811 0.67 C12=CC(OCOC3=C(OCC#C)C=C4C(C(=O)CC(C)(C)O4)=C3)=C(C=C1OC(C)(C)CC2=O)OCC#C
MCULE-5234886160 0.67 C12C=C(CC)C(=CC=1OCC(C1=CC=CC3OCCOC1=3)C2=O)OC(C)C
MCULE-1916199374 0.67 C12OC3COC4=C(C=C(C(OC)=C4)OC)C3C(=O)C=1C=CC1=C2CC(O1)C(C)=O
MCULE-1736405258 0.67 C1(OC)C=CC(CC2COC3C=C(O)C=CC=3C2=O)=CC=1
MCULE-2154315081 0.67 C1(O)C=C2OCC(CC3C=CC(O)=CC=3)C(=O)C2=C(O)C=1
MCULE-7928773502 0.67 C12=C(C=CC3C(CC(C)(C)OC1=3)=O)OC(CC2C1=CC(OC)=C2C(OCO2)=C1)=O
MolPort-019-937-486 0.67 COC1=CC=C(CC2COC3=C(C=CC(O)=C3)C2=O)C=C1
MolPort-035-705-988 0.67 OC1=CC=C(CC2COC3=C(C(O)=CC(O)=C3)C2=O)C=C1
MolPort-035-700-180 0.67 COC1=CC(=CC2=C1OCO2)C1CC(=O)OC2=CC=C3C(=O)CC(C)(C)OC3=C12
MolPort-035-705-949 0.66 OC1=CC2=C(C(=O)C(O)(CC3=CC(O)=C(O)C(O)=C3)O2)C(O)=C1
MolPort-002-510-292 0.66 CCCC1=CC(C(=O)CC2=CC=C3OCOC3=C2)=C(O)C=C1OC
MolPort-002-486-330 0.66 OC1=CC=C(CC2COC3=C(C=CC(O)=C3)C2=O)C=C1
MolPort-005-944-928 0.66 COC1=C(OC)C=C2[C@H]3[C@H](OC4=C(C=CC5=C4C[C@@H](O5)C(C)=C)C3=O)C(O)OC2=C1
MCULE-8744659707 0.66 C1(O)C=C2OC(O)(C(=O)C2=C(O)C=1)CC1C=C(O)C(O)=C(O)C=1
MCULE-6714219715 0.66 C1(C=C(CCC)C(=CC=1O)OC)C(=O)CC1C=CC2=C(OCO2)C=1
MCULE-8240919679 0.66 C1(O)C=C2OCC(CC3C=CC(O)=CC=3)C(=O)C2=CC=1
MCULE-3002316905 0.66 C1=C2O[C@@H](C(=C)C)CC2=C2O[C@]3([H])C(O)OC4C=C(OC)C(OC)=CC=4[C@]3([H])C(C2=C1)=O
MCULE-7028658249 0.66 C1(C=C2O[C@@H](C3C=CC(=CC=3)O)[C@H](C3C(O)=CC(O)=C4C(=O)C[C@H](C5C=CC(O)=CC=5)OC=34)C(C2=C(O)C=1)=O)O
MCULE-4917078155 0.66 O1COC2C=C3C(C4C=C(OC)C(OC)=C(OC)C=4)C(C(C)(O)OC3=CC1=2)C(C)=O
MCULE-9278940968 0.66 C1C(=C2C(=O)C[C@H](OC2=C2CCOC=12)C)OC
MCULE-3467826093 0.66 C12OC(CC(=O)C=1C(OC)=CC(OC)=C2OC)(C)C
MCULE-5956278100 0.66 C12C=C(OC)C(=CC=1OC(CC2=O)(C)C)OC
MolPort-046-158-465 0.66 COC1=CC=C(C[C@]2(O)COC3=CC(O)=CC(O)=C3C2=O)C=C1
MolPort-001-741-458 0.66 OC1=CC=C(C=C1)[C@H]1CC(=O)C2=C(O)C=C(O)C([C@H]3[C@@H](OC4=CC(O)=CC(O)=C4C3=O)C3=CC=C(O)C=C3)=C2O1
MolPort-046-158-480 0.66 OC1=CC=C(C=C1)[C@@H]1CC(=O)C2=C(O)C=C(O)C([C@@H]3[C@H](OC4=CC(O)=CC(O)=C4C3=O)C3=CC=C(O)C=C3)=C2O1
MolPort-005-944-003 0.66 COC1=C2C(=O)C[C@@H](C)OC2=C2CCOC2=C1
MolPort-001-793-312 0.66 COC1=CC2=C(C=C1OC)C(=O)CC(C)(C)O2
MolPort-046-761-034 0.65 COC1=CC=C(C[C@]2(O)COC3=CC(OC)=CC(O)=C3C2=O)C=C1
MolPort-000-693-539 0.65 CC1(C)CC(=O)C2=C(O1)C=C(OCC(=O)C1=CC=CC=C1)C=C2O
MolPort-000-659-596 0.65 CCC1=CC(C(=O)CC2=CC=C3OCOC3=C2)=C(O)C=C1OC
MolPort-046-790-523 0.65 OC1=CC=C(C[C@@]2(O)COC3=CC(O)=CC(O)=C3C2=O)C=C1
MolPort-035-873-369 0.65 O=C1CC(C2=CC3=C(OCO3)C=C2)C2=C3OC4(CCCCC4)CC(=O)C3=CC=C2O1
MolPort-002-823-526 0.65 COC(OC)C(C(=O)C1=C(OC)C(OCC2=CC=CC=C2)=C(OC)C=C1OC(C)=O)C1=C(O)C=C2OCOC2=C1
MCULE-7123585792 0.65 C12=C(O)C=C(C=C1OC(CC2=O)(C)C)OCC(C1C=CC=CC=1)=O
MCULE-4881069319 0.65 C1(C=C(CC)C(=CC=1O)OC)C(=O)CC1C=CC2=C(OCO2)C=1
MCULE-5701394615 0.65 C1(C(OC(C)=O)=CC(=C(OCC2C=CC=CC=2)C=1OC)OC)C(=O)C(C(OC)OC)C1=CC2OCOC=2C=C1O
MCULE-8102344085 0.65 C12C(=CC=C3C(CC4(CCCCC4)OC=13)=O)OC(CC2C1C=CC2=C(OCO2)C=1)=O
MCULE-8407686947 0.65 C12OC(C)(C)CC(=O)C1=CC=C(OC)C=2O
MCULE-2474505946 0.65 C1=CC(C(C(C2=C(OC)C3OCOC=3C(OC)=C2)C(OC)OC)=O)=CC=C1OO
MCULE-7167906156 0.65 C12OC(C)(C)CC(=O)C1=CC(C(C)(C)C)=C(O)C=2O
MCULE-7287067191 0.65 C12O[C@]3([H])COC4C(=CC(=C(OC)C=4)OC)[C@@]3(C(=O)C1=CC=C1C=2C[C@@H](O1)C(C)=C)[H]
MCULE-9222232228 0.65 C(C)(=C)C1CC2=C(C=CC3C(C4(C5C=C(OC)C(OC)=CC=5OCC4([H])OC=32)[H])=O)O1
MCULE-7415617623 0.65 C12O[C@]3([H])COC4=C(C=C(C(OC)=C4)OC)[C@@]3(C(=O)C1=CC=C1C=2C[C@@H](O1)C(C)=C)[H]
MCULE-7428900363 0.65 C12C(C(O)=O)CC1=CC1OCOC=1C=2
MCULE-7574811466 0.65 O1C2=C(C=CC3=C2C[C@H](C(=C)C)O3)C([C@@H]2C3=CC(=C(C=C3OC[C@@H]12)OC)OC)=O
MCULE-7325867187 0.65 C12C=C(OC)C(=CC=1OC(CC2=O)(C)C)OCC
MCULE-8328465292 0.65 C1=C(O)C=C2C=C3C(=C(C2=C1OC)O)C(=O)CC(O)(C)O3
MolPort-039-341-535 0.65 COC(OC)C(C(=O)C1=CC=C(OO)C=C1)C1=CC(OC)=C2OCOC2=C1OC
MolPort-001-766-894 0.65 CC(C)(C)C1=C(O)C(O)=C2OC(C)(C)CC(=O)C2=C1
MolPort-016-633-338 0.65 COC1=CC2=C(C=C1OC)[C@H]1[C@@H](CO2)OC2=C(C=CC3=C2CC(O3)C(C)=C)C1=O
MolPort-002-507-351 0.65 COC1=C(OC)C=C2[C@H]3[C@@H](COC2=C1)OC1=C(C=CC2=C1C[C@@H](O2)C(C)=C)C3=O
MolPort-001-794-641 0.65 COC1=C(OC)C=C2C3C(COC2=C1)OC1=C(C=CC2=C1CC(O2)C(C)=C)C3=O
MolPort-001-739-255 0.65 COC1=CC(O)=CC2=CC3=C(C(=O)CC(C)(O)O3)C(O)=C12
MolPort-003-849-812 0.64 COC1=CC(OC)=C2C(=O)CC(OC2=C1)C1=CC(OC)=C(OC)C(OC)=C1
MolPort-001-739-248 0.64 COC1=C2C(=O)C[C@@H](C)OC2=C(CCO)C(O)=C1
MolPort-046-158-531 0.64 COC1=CC(O)=C2C(=O)C[C@H](OC2=C1)C1=CC(OC)=C(O)C=C1
MolPort-005-944-811 0.64 COC1=CC=C2C(O[C@@H]3COC4=C(C=C(OC)C(OC)=C4)[C@]3(O)C2=O)=C1
MCULE-4510679729 0.64 C1C(OC)=C2C(=O)C[C@@H](C)OC2=C(C=1O)CCO
MCULE-9912319515 0.64 C1C=C2C(O[C@]3([H])COC4C=C(OC)C(OC)=CC=4[C@]3(O)C2=O)=CC=1OC
MCULE-3601358321 0.64 C1(O)C=C2O[C@H](C3C=CC=CC=3)CC(=O)C2=C(O)C=1OC
MCULE-9660679251 0.64 C1(O)C=C2OC(CC(C2=C(O)C=1OC)=O)C1C=CC=CC=1
MCULE-9587381415 0.64 C1(O)C=C2O[C@H](C3C=C(OC)C(O)=CC=3)CC(=O)C2=C(O)C=1
MCULE-3324355674 0.64 C1(C=C2OC(CC(C2=C(O)C=1)=O)C1=CC=C(O)C(OC)=C1)O
MCULE-2232530891 0.64 C1(OC)C=C2O[C@H](C3C=CC=CC=3)CC(=O)C2=C(O)C=1OC
MCULE-3493265138 0.64 C12C(OC)=CC(=CC=1OC(C(O)C2=O)C1C=CC(=C(OC)C=1)OC)OC
MCULE-7131810532 0.64 C12C(O)=CC(=CC=1O[C@@H](CC2=O)C1C=CC(=C(O)C=1)OC)O
MCULE-2236290715 0.64 C12=C(O)C=C(O)C=C1O[C@H](CC2=O)C1=CC=C(OC)C(O)=C1
MCULE-9396529091 0.64 C1(O)C=C2OC(CC(=O)C2=C(O)C=1)C1C=CC(OC)=C(O)C=1
MCULE-9044534531 0.64 C12C(O)=CC(O)=CC=1OC(CC2=O)C1C=CC(OC)=C(O)C=1
MCULE-2028448851 0.64 C1(O)C=C2O[C@@H](CC(=O)C2=C(O)C=1)C1C=CC(OC)=C(O)C=1
MCULE-9385881266 0.64 C1(O)C=C2O[C@H](C3C=C(O)C4O[C@@H](C5C=C(OC)C(O)=CC=5)[C@H](CO)C=4C=3)[C@@H](O)C(=O)C2=C(O)C=1
MCULE-2644639815 0.64 C1(COC2=CC=CC=C2C1=O)C1C=CC=CC=1
MCULE-9665743057 0.64 C1(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)C=C2OCC(C3C=CC(O)=CC=3)C(=O)C2=CC=1
MCULE-5742809714 0.64 C1(OC)C(OC)=C2O[C@H](C3C=CC=CC=3)CC(=O)C2=C(OC)C=1O
MolPort-039-338-620 0.64 COC1=C(O)C=C2O[C@@H](CC(=O)C2=C1O)C1=CC=CC=C1
MolPort-046-153-732 0.64 COC1=CC(=CC=C1O)[C@@H]1CC(=O)C2=C(O)C=C(O)C=C2O1
MolPort-001-740-631 0.64 COC1=C(O)C=C2OC(CC(=O)C2=C1O)C1=CC=CC=C1
MolPort-001-740-728 0.64 COC1=C(O)C=CC(=C1)C1CC(=O)C2=C(O)C=C(O)C=C2O1
MolPort-046-158-525 0.64 COC1=CC(O)=C2C(=O)C[C@H](OC2=C1)C1=CC(OC)=C(OC)C=C1
MolPort-039-338-699 0.64 COC1=C(OC)C(O)=C2C(=O)C[C@H](OC2=C1)C1=CC=CC=C1
MolPort-046-689-929 0.64 [2H]C([2H])([2H])OC1=C(O)C=C(C=C1)C1CC(=O)C2=C(O)C=C(O)C=C2O1
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