SANC01004 6-Deoxyisojacareubin




Analog ID Similarity score SMILES

Selection options

Mcule | MolPort | All | None
MolPort-046-760-998 0.86 CC1(C)Oc2cc3oc4c(O)cccc4c(=O)c3c(O)c2C=C1
MCULE-2883417183 0.84 C12C(O)=CC3OC(C)(C)C=CC=3C=1OC(=O)C=C2
MolPort-039-338-668 0.84 CC1(C)Oc2cc(O)c3ccc(=O)oc3c2C=C1
MCULE-7071226808 0.82 C12OC(C)(C)C=CC1=C1OC=C(C3C=CC(O)=CC=3)C(=O)C1=C(O)C=2
MolPort-039-052-681 0.82 CC1(C)Oc2cc(O)c3c(occ(-c4ccc(O)cc4)c3=O)c2C=C1
MCULE-2505652352 0.79 C12C=CC(C)(C)OC=1C(O)=C1OC3C=C(O)C=C(O)C=3C(=O)C1=C2
MolPort-035-706-485 0.79 CC1(C)Oc2c(O)c3oc4cc(O)cc(O)c4c(=O)c3cc2C=C1
MCULE-6706146422 0.78 C1C=C2C(=O)C3C(O)=C4C=CC(C)(C)OC4=C(C(C)(C)C=C)C=3OC2=C(O)C=1O
MolPort-000-881-050 0.78 CC1(C)Oc2ccc3ccc(=O)oc3c2C=C1
MolPort-001-742-714 0.78 CC1(CO)Oc2cc(O)c3c(occ(-c4ccc(O)cc4)c3=O)c2C=C1
MolPort-001-736-557 0.78 CC(C)(C=C)c1c2OC(C)(C)C=Cc2c(O)c2c1oc1c(O)c(O)ccc1c2=O
MCULE-4757839799 0.77 C12C(O)=C3C(OC(C=C3)(C)C)=CC=1OC1C=CC(OC(C)=O)=CC=1C2=O
MCULE-3018809144 0.77 C1(C2C(=O)C3C(=CC4OC(C)(C)C=CC=4C=3O)OC=2)=CC=C(O)C=C1
MolPort-003-804-185 0.77 CC1(C)Oc2cc3occ(-c4ccc(O)cc4)c(=O)c3c(O)c2C=C1
MCULE-9357202282 0.75 C12OC(C)(C)C=CC1=C1OC(C3C=CC(O)=CC=3)=CC(=O)C1=C(O)C=2
MCULE-5952943329 0.75 C12C=CC(C)(C)OC=1C(O)=C1OC3C(C/C=C(\C)/C)=C(OC)C=C(O)C=3C(=O)C1=C2
MCULE-5353680333 0.75 C1C(OC)=C2C(C=C(C3=CC=CC=C3)OC2=C2C=CC(C)(C)OC2=1)=O
MolPort-001-741-497 0.75 COc1cc2OC(C)(C)C=Cc2c2oc(cc(=O)c12)-c1ccccc1
MolPort-039-141-800 0.75 CC1(C)Oc2cc(O)c3c(oc(cc3=O)-c3ccc(O)cc3)c2C=C1
MolPort-035-706-486 0.75 COc1cc(O)c2c(oc3c(O)c4OC(C)(C)C=Cc4cc3c2=O)c1CC=C(C)C
MCULE-5256697366 0.74 CC(=O)OC1C=CC(C2C(=O)C3C(=C4C(=CC=3OC=2)OC(C)(C)C=C4)O)=CC=1
MCULE-7853104874 0.74 C12OC(C)(C)C=CC=1C=C1C(=O)C(C3C=CC(O)=CC=3)=COC1=C2
MCULE-6081905892 0.74 C12OC(C)(C)C=CC=1C(O)=C1C(=O)C(C3C=CC(O)=CC=3O)=COC1=C2
MolPort-035-683-208 0.74 CC(=O)Oc1ccc(cc1)-c1coc2cc3OC(C)(C)C=Cc3c(O)c2c1=O
MolPort-019-937-414 0.74 CC1(C)Oc2cc3occ(-c4ccc(O)cc4O)c(=O)c3c(O)c2C=C1
MolPort-039-338-842 0.74 CC1(C)Oc2cc3occ(-c4ccc(O)cc4)c(=O)c3cc2C=C1
MCULE-6369952685 0.73 C12C=C(O)C3OC(C)(C)C=CC=3C=1OC(=O)C=C2
MCULE-2006868290 0.73 C12C(O)=C(C/C=C(/C)\C)C3=C(C=CC(C)(C)O3)C=1OC=C(C1=CC=C(C=C1)O)C2=O
MCULE-4403418176 0.73 C12OC(C)(CO)C=CC=1C(O)=C1C(=O)C(C3C=CC(O)=CC=3)=COC1=C2
MolPort-001-741-965 0.73 CC(C)=CCc1c(O)c2c(occ(-c3ccc(O)cc3)c2=O)c2C=CC(C)(C)Oc12
MolPort-035-705-760 0.73 CC1(C)Oc2c(O)cc3ccc(=O)oc3c2C=C1
MolPort-035-705-993 0.73 CC1(CO)Oc2cc3occ(-c4ccc(O)cc4)c(=O)c3c(O)c2C=C1
MCULE-4967020572 0.72 C12OC(C)(C)C=CC1=C1OC(C3C=CC=CC=3)=CC(=O)C1=CC=2
MolPort-006-668-455 0.72 CC1(C)Oc2ccc3c(oc(cc3=O)-c3ccccc3)c2C=C1
MolPort-001-741-750 0.72 COc1c2C=CC(C)(C)Oc2cc2oc(=O)ccc12
MCULE-9824732462 0.71 C12=C(O)C=C(C=C1OC1C(=CC=CC=1)C2=O)OCC=CC1C=CC=CC=1
MCULE-9377674082 0.71 C12C=C(OC)C3OC(C)(C)C=CC=3C=1OC(=O)C=C2
MolPort-002-530-353 0.71 Oc1cc(OC\C=C\c2ccccc2)cc2oc3ccccc3c(=O)c12
MolPort-035-705-768 0.71 COc1cc2ccc(=O)oc2c2C=CC(C)(C)Oc12
MCULE-5983659423 0.70 C1(=C2OC(C)(C)C=CC2=C2OC=C(C3C=CC(=CC=3O)O)C(=O)C2=C1O)C/C=C(/C)\C
MCULE-1642915202 0.70 C12=C(C)C3OC(C)(C)C=CC=3C=C1C1=C(C=CC=C1)C(=O)O2
MCULE-3476922697 0.70 C1(=C2OC(C)(C)C=CC2=C2OC=C(C3C=CC(=C(O)C=3)O)C(=O)C2=C1O)C/C=C(/C)\C
MCULE-7025197927 0.70 C12C(C/C=C(/C)\C)=C(O)C(O)=C(C/C=C(\C)/C)C=1C(=O)C1C(O)=C3C=CC(C)(C)OC3=CC=1O2
MCULE-3358442738 0.70 C12=CC(OC)=C3C(C=CC(C)(C)O3)=C1OC=C(C1=CC=C(C(OC)=C1)OC)C2=O
MCULE-4036011682 0.70 O1C2=CC(=C3C(C(=COC3=C2C=CC1(C)C)C1C=C(C(=CC=1OC)OC)OC)=O)O
MolPort-023-274-353 0.70 COc1ccc(cc1OC)-c1coc2c3C=CC(C)(C)Oc3c(OC)cc2c1=O
MolPort-003-665-850 0.70 CC(C)=CCc1c(O)c2c(occ(-c3ccc(O)c(O)c3)c2=O)c2C=CC(C)(C)Oc12
MolPort-006-319-011 0.70 Cc1c2OC(C)(C)C=Cc2cc2c1oc(=O)c1ccccc21
MolPort-005-945-444 0.70 CC(C)=CCc1c(O)c2c(occ(-c3ccc(O)cc3O)c2=O)c2C=CC(C)(C)Oc12
MolPort-044-754-130 0.70 CC(C)=CCc1c(O)c(O)c(CC=C(C)C)c2c1oc1cc3OC(C)(C)C=Cc3c(O)c1c2=O
MolPort-044-181-349 0.70 COc1cc(OC)c(cc1OC)-c1coc2c3C=CC(C)(C)Oc3cc(O)c2c1=O
MCULE-4193827138 0.69 C1C2OC(C)(C)C=CC=2C=C2C=1OC(C=C2)=O
MCULE-9710764172 0.69 C1(O)C=C2OC=C(C3C=C4C=CC(C)(C)OC4=CC=3)C(=O)C2=C(O)C=1
MCULE-2319378665 0.69 C12C(C/C=C(\C)/C)=C(OC)C(O)=CC=1OC1C=C3OC(C)(C)C=CC3=C(O)C=1C2=O
MolPort-000-882-084 0.69 CC1(C)Oc2cc3oc(=O)ccc3cc2C=C1
MolPort-029-887-080 0.69 COc1c(O)cc2oc3cc4OC(C)(C)C=Cc4c(O)c3c(=O)c2c1CC=C(C)C
MolPort-039-338-543 0.69 CC1(C)Oc2ccc(cc2C=C1)-c1coc2cc(O)cc(O)c2c1=O
MCULE-8588575393 0.68 C1C=C2C=CC(=O)OC2=C(/C=C/C(O)(C)C)C=1OC
MCULE-6238286778 0.68 C12OC(C)(C)C=CC1=C1OC(C3C=CC=CC=3)=CC(=O)C1=CC=2O
MCULE-1498181538 0.68 C1(=C2C(C=C(C3=CC=C(O)C=C3)OC2=CC2OC(C)(C)C=CC=21)=O)O
MCULE-9883206898 0.68 C12C3OC(C)(C)CCC=3C3=C(C=CC(C)(C)O3)C=1OC=C(C1=CC=C(C=C1)O)C2=O
MCULE-5058484967 0.68 C1(O)C=C2OC=C(C3C=C4C=CC(C)(C)OC4=CC=3)C(=O)C2=CC=1
MolPort-006-668-656 0.68 CC1(C)Oc2c(O)cc3c(oc(cc3=O)-c3ccccc3)c2C=C1
MolPort-035-705-771 0.68 COc1ccc2ccc(=O)oc2c1\C=C\C(C)(C)O
MolPort-028-599-888 0.68 CC1(C)Oc2ccc(cc2C=C1)-c1coc2cc(O)ccc2c1=O
MolPort-046-158-408 0.68 CC1(C)Oc2ccc(c(O)c2C=C1)-c1coc2cc(O)cc(O)c2c1=O
MolPort-005-944-619 0.68 CC1(C)Oc2cc3oc(cc(=O)c3c(O)c2C=C1)-c1ccc(O)cc1
MolPort-001-913-434 0.68 CC1(C)CCc2c3OC(C)(C)C=Cc3c3occ(-c4ccc(O)cc4)c(=O)c3c2O1
MCULE-9289115406 0.67 C12=C(C=CC3=C1OC(C=C3)=O)OC(C(OC)=C2)(C)C
MCULE-4906359601 0.67 CC1(C)OC2C=CC(C3C(=O)C4C=CC(O)=CC=4OC=3)=C(O)C=2C=C1
MCULE-9474298566 0.67 C12C(C(C)(C)C=C)=C(O)C=C(O)C=1C(=O)C1C3C=CC(C)(C)OC=3C(O)=CC=1O2
MolPort-035-706-468 0.67 CC(C)(C=C)c1c(O)cc(O)c2c1oc1cc(O)c3OC(C)(C)C=Cc3c1c2=O
MolPort-046-156-413 0.67 CC1(C)Oc2ccc(c(O)c2C=C1)-c1coc2cc(O)ccc2c1=O
MolPort-002-087-751 0.67 COC1=Cc2c(OC1(C)C)ccc1ccc(=O)oc21
MCULE-6667636668 0.66 C12OC(C)(C)C=CC1=C1OC=C(C3C=CC(O)=CC=3O)C(=O)C1=C(O)C=2CC(O)C(O)(C)C
MCULE-9553896038 0.66 C12OC(C)(C)C=CC=1C(O)=C1C(=O)C(C3C=CC(O)=CC=3)=COC1=C2C/C=C(/C)\C
MCULE-4536287471 0.66 C12OC(C)(C)C=CC1=C1OC=C(C3C=CC(O)=CC=3O)C(=O)C1=C(O)C=2CC(O)C(C)=C
MCULE-8978789018 0.66 C1C=C2C=CC(=O)OC2=C(/C=C/C(O)(C)CO)C=1OC
MCULE-9778648334 0.66 O=C1C=CC2=C(OC)C3C=CC(C)(C)OC=3C(OC)=C2O1
MolPort-039-141-832 0.66 COc1ccc2ccc(=O)oc2c1\C=C\C(C)(O)CO
MolPort-038-386-096 0.66 CC(=C)C(O)Cc1c(O)c2c(occ(-c3ccc(O)cc3O)c2=O)c2C=CC(C)(C)Oc12
MolPort-038-386-091 0.66 CC(C)(O)C(O)Cc1c(O)c2c(occ(-c3ccc(O)cc3O)c2=O)c2C=CC(C)(C)Oc12
MolPort-005-945-815 0.66 COc1c2OC(C)(C)C=Cc2c(OC)c2ccc(=O)oc12
MolPort-019-997-410 0.66 CC(C)=CCc1c2OC(C)(C)C=Cc2c(O)c2c1occ(-c1ccc(O)cc1)c2=O
MCULE-1669110017 0.65 C1(O)C=C2OC=C(C3C=C4C=CC(C)(C)OC4=CC=3)C(=O)C2=C(O)C=1C/C=C(\C)/C
MCULE-8880190011 0.65 C(C1C(=O)OC2C(=C3OC(C)(C)C=CC3=C(C=2C=1)O)C(C)(C)C=C)(C=C)(C)C
MCULE-7440039211 0.65 O=C1C(C2C=C3OCOC3=CC=2OC)=COC2C1=CC=C1OC(C)(C)C=CC1=2
MCULE-1107301039 0.65 C1(O)C=C2OC=C(C3C=C4C=CC(C)(C)OC4=C(O)C=3)C(=O)C2=C(O)C=1
MolPort-042-624-484 0.65 CC1(C)Oc2c(O)cc(cc2C=C1)-c1coc2cc(O)cc(O)c2c1=O
MolPort-005-944-760 0.65 CC(C)(C=C)c1cc2c(O)c3C=CC(C)(C)Oc3c(c2oc1=O)C(C)(C)C=C
MolPort-046-761-011 0.65 CC1(C)Oc2c(ccc(O)c2C=C1)-c1coc2cc(O)cc(O)c2c1=O
MolPort-039-338-260 0.65 CC(C)=CCc1c(O)cc2occ(-c3ccc4OC(C)(C)C=Cc4c3)c(=O)c2c1O
MCULE-7021689934 0.64 C12=C(C)C(OCC=CC3C=CC=CC=3)=CC=C1C1C=CC=CC=1C(=O)O2
MCULE-2735023400 0.64 C12OC(C)(C)C=CC=1C=C1C(=O)C(C3C(OC)=CC(OC)=C(OC)C=3)=COC1=C2
MCULE-6831881472 0.64 O=C1C=CC2=CC3C=CC(C)(C)OC=3C(OC)=C2O1
MCULE-7599859422 0.64 C12OC(C)(C)C=CC=1C(O)=C1C(=O)C(C3C(O)=CC(O)=CC=3)=COC1=C2C/C=C(\C)/C
MCULE-7456276136 0.64 C12=C(C)C(OCC=CC3C=CC=CC=3)=CC=C1C1C=CC(=CC=1C(=O)O2)OC
MCULE-9698046612 0.64 OC1C(O)=CC(C2=COC3C(C2=O)=C(C2C=CC(C)(C)OC=2C=3C/C=C(\C)/C)O)=CC=1
MolPort-005-945-602 0.64 CC(C)=CCc1c2OC(C)(C)C=Cc2c(O)c2c1occ(-c1ccc(O)c(O)c1)c2=O
MolPort-035-705-990 0.64 COc1cc(OC)c(cc1OC)-c1coc2cc3OC(C)(C)C=Cc3cc2c1=O
MolPort-001-804-882 0.64 Cc1c(OC\C=C\c2ccccc2)ccc2c3ccccc3c(=O)oc12
MolPort-005-945-814 0.64 COc1c2OC(C)(C)C=Cc2cc2ccc(=O)oc12
MolPort-002-367-677 0.64 COc1ccc2c3ccc(OC\C=C\c4ccccc4)c(C)c3oc(=O)c2c1
MCULE-1361583720 0.63 C1(/C=C(/C#N)\C#N)=C(Cl)C(C)(C)OC2=CC=C3C=CC(=O)OC3=C12
MCULE-4918721969 0.63 C12=C3C=CC(OC3=CC(OC)=C1C1=C(CCC1)C(=O)O2)(C)C
MCULE-2591793341 0.63 C12=C(C)C(OCC=CC3=CC=CC=C3)=CC=C1C(=CC(=O)O2)C
MCULE-3775584339 0.63 C1(C=O)=C(Cl)C(C)(C)OC2C=CC3C=CC(=O)OC=3C1=2
MolPort-002-144-731 0.63 CC1(C)Oc2ccc3ccc(=O)oc3c2C(C=O)=C1Cl
MolPort-002-261-026 0.63 Cc1cc(=O)oc2c(C)c(OC\C=C\c3ccccc3)ccc12
MolPort-002-536-308 0.63 COc1cc2OC(C)(C)C=Cc2c2oc(=O)c3CCCc3c12
MCULE-7587230126 0.62 C12=C(C=CC3=C1OC(C=C3)=O)OC(C(OC(C)=O)=C2)(C)C
MCULE-1030338663 0.62 C12=C3C=CC(OC3=CC(OC)=C1C1=C(CCCC1)C(=O)O2)(C)C
MCULE-6316428267 0.62 C12=C(C)C(OCC=CC3C=CC=CC=3)=CC=C1C(C)=C(C(=O)O2)C
MolPort-002-528-882 0.62 COc1cc2OC(C)(C)C=Cc2c2oc(=O)c3CCCCc3c12
MolPort-002-215-543 0.62 CC(=O)OC1=Cc2c(OC1(C)C)ccc1ccc(=O)oc21
MolPort-001-819-623 0.62 Cc1c(C)c(=O)oc2c(C)c(OC\C=C\c3ccccc3)ccc12
MolPort-002-237-229 0.61 Cc1cc(OC\C=C\c2ccccc2)c2c(C)c(C)c(=O)oc2c1
MolPort-001-831-755 0.61 CCc1cc(=O)oc2c(C)c(OC\C=C\c3ccccc3)ccc12
MCULE-1039382880 0.61 C1(=O)OC2=CC(OCC=CC3=CC=CC=C3)=CC=C2C(C)=C1C
MCULE-2321682963 0.61 C1C=C2C=CC(=O)OC2=C(/C=C\C(C)=C)C=1OC
MCULE-7992480599 0.61 C1C(=C2C(=C3C=CC(C)(C)OC=13)OC(C1=C(C=C(C=C1)O)O)=C(C/C=C(/C)\C)C2=O)O
MCULE-7775364254 0.61 C1C=CC=C(C2=CC(=O)OC3C4C=CC(C)(C)OC=4C(C(=O)C(C)C)=C(O)C2=3)C=1
MCULE-6205993073 0.61 C1(C)=C(C)C(=O)OC2=CC(C)=CC(OCC=CC3=CC=CC=C3)=C12
MCULE-4016967214 0.61 C1C=C2C=CC(=O)OC2=C(/C=C/C(=O)C)C=1OC
MCULE-5800893889 0.61 C12=C(C)C(OCC=CC3=CC=CC=C3)=CC=C1C(=CC(=O)O2)CC
MolPort-039-338-277 0.61 COc1ccc2ccc(=O)oc2c1\C=C/C(C)=C
MolPort-039-338-278 0.61 COc1ccc2ccc(=O)oc2c1\C=C\C(C)=O
MolPort-023-274-297 0.61 CC(C)C(=O)c1c(O)c2c(cc(=O)oc2c2C=CC(C)(C)Oc12)-c1ccccc1
MolPort-001-831-820 0.61 Cc1c(C)c(=O)oc2cc(OC\C=C\c3ccccc3)ccc12
MolPort-001-741-197 0.61 CC(C)=CCc1c(oc2c3C=CC(C)(C)Oc3cc(O)c2c1=O)-c1ccc(O)cc1O
MolPort-002-515-338 0.60 COc1ccc2c(c1)occ(\C=C\C(O)=O)c2=O
MolPort-005-945-202 0.60 CCC(C)C(=O)c1c(O)c2c(cc(=O)oc2c2C=CC(C)(C)Oc12)-c1ccccc1
MCULE-3628122338 0.60 C12C=CC(=CC=1OC=C(C=CC(O)=O)C2=O)OC
MCULE-8359512042 0.60 C12=CC(=CC=C1C(C)=CC(=O)O2)OC(=O)C=CC1=CC=C(C=C1OC)OC
MCULE-2376660047 0.60 O=C1C=C(C2=C(O)C(C(C(C)CC)=O)=C3OC(C)(C)C=CC3=C2O1)C1=CC=CC=C1
MCULE-6660580688 0.60 C1(=O)C2C=CC=CC=2C2C(=CC(=CC=2)OCC=CC2=CC=CC=C2)O1
MCULE-5124173497 0.60 O=C1OC2=C(C=CC(=C2)OCC=CC2=CC=CC=C2)C=C1
MCULE-1455065403 0.60 C1(C)=CC(=O)OC2=CC(C)=CC(OCC=CC3C=CC=CC=3)=C12
MCULE-2481524965 0.60 C12=CC(OCC=CC3=CC=CC=C3)=CC=C1C(C)=CC(=O)O2
MCULE-5232464883 0.60 C12=C(C)C3OC4(CCCC(C)C4)C=CC=3C=C1C1=C(CCC1)C(=O)O2