SANC00437 7-Methyljuglone




Analog ID Similarity score SMILES

Selection options

Mcule | MolPort | All | None
MolPort-000-725-926 0.90 OC1=CC=CC2=C1C(=O)C=CC2=O
MCULE-5238429657 0.90 C12C(=CC=CC=1C(C=CC2=O)=O)O
MCULE-5449007416 0.89 C12C(O)=CC=C(O)C=1C(C=CC2=O)=O
MolPort-001-789-071 0.89 OC1=CC=C(O)C2=C1C(=O)C=CC2=O
MCULE-3659335670 0.86 C12C(O)=CC(=C(O)C=1C(C(C)=C(C)C2=O)=O)C
MolPort-002-525-817 0.86 CC1=C(O)C2=C(C(O)=C1)C(=O)C(C)=C(C)C2=O
MCULE-6783012875 0.83 C12C(O)=C(C(C)(C)C)C=CC=1C(C(C(C)(C)C)=CC2=O)=O
MolPort-002-175-234 0.83 CC(C)(C)C1=CC(=O)C2=C(C=CC(=C2O)C(C)(C)C)C1=O
MCULE-9727790480 0.81 C12C(=O)C=CC(=O)C1=C(C=C(C)C=2Cl)O
MolPort-022-388-973 0.81 CC1=C(Cl)C2=C(C(O)=C1)C(=O)C=CC2=O
MCULE-9327502882 0.80 C1C=C2C(=C(O)C=1)C(=O)C=C(C)C2=O
MolPort-046-774-401 0.80 CC1=CC(=O)C2=CC=CC(O)=C2C1=O
MolPort-000-165-362 0.80 CC1=CC(=O)C2=C(O)C=CC=C2C1=O
MolPort-003-848-972 0.79 CC1=CC2=C(C=C1)C(=O)C=CC2=O
MolPort-002-525-117 0.78 CC1=CC(=O)C2=C(C(O)=CC=C2O)C1=O
MCULE-2172866621 0.78 C12C(O)=CC=C(O)C=1C(C=C(C)C2=O)=O
MolPort-003-724-025 0.77 COC1=CC=CC2=C1C(=O)C=CC2=O
MCULE-3075732993 0.77 C12C(=O)C=CC(=O)C=1C=CC=C2OC
MCULE-7808967879 0.77 C1(=O)C=C(O)C(C2C=CC=C(O)C=21)=O
MolPort-002-508-980 0.77 OC1=CC(=O)C2=C(C=CC=C2O)C1=O
MolPort-002-510-067 0.76 CC1=C(O)C2=C(C(O)=C1)C(=O)C(Cl)=C(Cl)C2=O
MCULE-3085518701 0.76 C12C(O)=CC(=C(O)C=1C(C(Cl)=C(Cl)C2=O)=O)C
MCULE-1305547074 0.76 O=C1C=CC(C2C=C3C=CC=CC3=C(OC)C=21)=O
MCULE-4692972225 0.76 C12C(=CC=CC=1C(=O)C=C(O)C2=O)O
MolPort-002-510-857 0.76 OC1=CC(=O)C2=C(C(O)=CC=C2)C1=O
MCULE-9908483313 0.75 O=C1C2C=C(C)C(CC=CCC)=C(O)C=2C(C2C=CC=CC=21)=O
MCULE-3097202288 0.74 C1(O)C(=O)C2C(O)=CC=C(O)C=2C(=O)C=1O
MCULE-3411778567 0.74 O=C1C2C=CC(CC=CCC)=C(O)C=2C(C2C=CC=CC=21)=O
MCULE-1859799192 0.73 ClC1=C2C=CC=CC2=C(O)C2C(C=CC(C=21)=O)=O
MCULE-8194851493 0.73 C12C(=O)C=C(Cl)C(=O)C=1C(O)=CC=C2
MolPort-022-880-231 0.73 OC1=CC=CC2=C1C(=O)C(Cl)=CC2=O
MolPort-035-706-162 0.72 COC1=CC(=O)C2=C(O)C(C(C)=O)=C(C)C=C2C1=O
MolPort-002-510-524 0.72 CC1=C(O)C2=C(C(O)=C1O)C(=O)C(Cl)=C(Cl)C2=O
MCULE-4218922051 0.72 C1(C)=CC2C(=O)C(OC)=CC(=O)C=2C(O)=C1C(=O)C
MCULE-1464405441 0.72 C12=C(C=CC=C1C(=O)C=C(Br)C2=O)O
MolPort-009-014-580 0.72 OC1=CC=CC2=C1C(=O)C(Br)=CC2=O
MCULE-3990535937 0.71 C1=C(O)C2C(=O)C=CC(=O)C=2C(C2=C(O)C3C(=O)C=CC(=O)C=3C=C2C)=C1C
MolPort-035-706-163 0.71 CC1=CC2=C(C(=O)C=CC2=O)C(O)=C1C1=C2C(=O)C=CC(=O)C2=C(O)C=C1C
MolPort-002-551-077 0.70 OC1=CC=CC2=C1C(=O)C(Cl)=C(Cl)C2=O
MolPort-046-203-943 0.70 CC1=CC2=C(C=C1)C(=O)C(C)=C(C)C2=O
MCULE-9362742957 0.70 C1(Cl)C(=O)C2C(=CC=CC=2C(=O)C=1Cl)O
MCULE-1508809186 0.70 C1(=C(O)C=CC(O)=C1CC=C)C(C)=O
MCULE-4010191653 0.70 C12C(C(Cl)=C(Cl)C(C=1C(O)=CC=C2O)=O)=O
MCULE-3798426177 0.70 C1(=O)C=C(C)C(C2=CC=CC(OC)=C21)=O
MolPort-001-762-018 0.70 CC(=O)C1=C(O)C=CC(O)=C1CC=C
MolPort-003-662-179 0.70 OC1=CC=C(O)C2=C1C(=O)C(Cl)=C(Cl)C2=O
MolPort-002-845-829 0.70 COC1=CC=CC2=C1C(=O)C=C(C)C2=O
MCULE-1156827451 0.69 C1(=CC(C)=CC=C1O)C(=O)C([H])=C([H])C(O)=O
MCULE-4996549760 0.68 C12=CC=CC=C1C(C=CC2=O)=O
MolPort-001-781-863 0.68 OC1=C2CC=CCC2=CC=C1
MolPort-001-768-930 0.68 O=C1C=CC(=O)C2=CC=CC=C12
MolPort-021-804-647 0.67 CCCCCCCC1=C(O)C=C(CC=C(C)C)C(O)=C1C=O
MCULE-9299404726 0.67 C12C(=O)C=CC(=O)C=1C(OCC1=CC=CC=C1)=CC=C2
MCULE-1811772745 0.67 C1C(O)=C(CCCCCCC)C(C=O)=C(O)C=1C/C=C(\C)/C
MCULE-3495034753 0.67 C12=CC=C3C=CC=CC3=C1C=CC1C(=O)C=CC(=O)C2=1
MCULE-3227564360 0.67 C1(C(=C(C(O)=CC=1C)C/C=C(/CC/C=C(\C)/CC/C=C(\C)/C)\C)O)C=O
MCULE-4103873123 0.67 O=C1C=CC(C2=CC3C=CC=CC=3C=C21)=O
MolPort-003-928-552 0.67 O=C1C=CC(=O)C2=C1C=CC1=C2C=CC2=C1C=CC=C2
MolPort-005-944-504 0.67 CC(C)=CCC\C(C)=C\CC\C(C)=C\CC1=C(O)C(C=O)=C(C)C=C1O
MolPort-001-822-219 0.67 O=C1C=CC(=O)C2=CC3=CC=CC=C3C=C12
MolPort-039-338-832 0.67 CC(C)C1=CC2=C(C(O)=C1O)[C@@]1(C)CCCC(C)(C)C1=CC2=O
MolPort-002-916-085 0.66 CC(=O)OC1=C2C(=O)C=CC(=O)C2=CC=C1
MolPort-006-328-955 0.66 CC1=CC(=O)C2=C(C=CC=C2C)C1=O
MolPort-000-141-945 0.66 OC1=CC=CC(C=O)=C1CC=C
MCULE-8326175399 0.66 C12C(=O)C=CC(=O)C1=CC=CC=2OC(=O)C
MCULE-8927502465 0.66 C1(C)=C2C(=O)C=C(C)C(=O)C2=CC=C1
MCULE-6335201883 0.66 C1(C(=O)/C=C(\C)/C)C(C)=C(C)C(=C(C)C=1C)C
MCULE-1835119929 0.66 C1(C)C(C)=C(C)C(=C(C)C=1C(=O)C=CC)C
MCULE-3452468482 0.66 C1(=C(C)C=C(C)C(C)=C1)C(=O)/C=C(\C)/C
MCULE-7504268106 0.66 C1(CC=C)=C(C=CC=C1C=O)O
MCULE-7973548523 0.66 C1(C(=O)C=CC)=C(C)C=C(C)C(C)=C1
MCULE-7003819614 0.66 C12C(O)=CC(=C(O)C=1C(C(Cl)=C(Cl)C2=O)=O)O
MCULE-1866414443 0.66 O=C1C2C=CC(CC=C)=C(O)C=2C(C2C=CC=CC=21)=O
MCULE-9221058385 0.66 C1(C(C)(C)C)=CC(=O)C2=C(C=CC(C(C)(C)C)=C2)C1=O
MCULE-4175598789 0.66 C1(C(=O)C=CC(O)=O)=C(C)C=C(C(C)=C1)C
MCULE-8054028509 0.66 C12C(=CC=CC=1C(=O)C=C(O)C2=O)OC
MolPort-002-508-798 0.66 OC1=CC(O)=C(O)C2=C1C(=O)C(Cl)=C(Cl)C2=O
MolPort-003-891-668 0.66 OC1=C(CC=C)C=CC2=C1C(=O)C1=C(C=CC=C1)C2=O
MolPort-003-803-846 0.66 COC1=CC=CC2=C1C(=O)C(O)=CC2=O
MolPort-002-509-543 0.65 OC1=CC(Cl)=C(O)C2=C1C(=O)C(O)=C(O)C2=O
MolPort-001-835-199 0.65 CC(C)(C)C1=CC=C2C(=O)C=C(C(=O)C2=C1)C(C)(C)C
MCULE-6531409814 0.65 C12C(O)=CC(=C(O)C=1C(C(O)=C(O)C2=O)=O)Cl
MCULE-2385629249 0.65 O=C1C2C=C(C)C(CC=CCC)=C(OC)C=2C(C2C=CC=CC=21)=O
MCULE-2811367517 0.65 CC(C1C(=O)C2=C(C=CC(C(C)(C)C)=C2)C(=O)C=1)(C)C
MCULE-8602199661 0.65 C1(=O)C2=C(C=CC(C)=C2)C(=O)C=C1O
MCULE-3023545161 0.65 C12C(=O)C=CC(=O)C1=C(C=CC=2OC(C)=O)OC(C)=O
MCULE-6532895949 0.65 C12C(=O)C=CC(=O)C1=C(C=CC=2OC(C)=O)O
MCULE-1405580005 0.65 C1(C(C)=CC(=C(C)C=1)OC)C(=O)/C=C(\C)/C
MCULE-7685844088 0.65 C1(C(=O)C=CC)C(C)=CC(=C(C)C=1)OC
MolPort-002-806-731 0.65 CC(=O)OC1=CC=C(O)C2=C1C(=O)C=CC2=O
MolPort-002-806-736 0.65 CC(=O)OC1=CC=C(OC(C)=O)C2=C1C(=O)C=CC2=O
MolPort-035-785-199 0.64 CC(C)=CCCC1=CC(=O)C2=C(C(O)=CC=C2O)C1=O
MCULE-8301916726 0.64 C1(C(C)C)C=C(C(C)C)C=C(C(C)C)C=1C(=O)C=CC
MCULE-6111046892 0.64 ClC1=C2C(C(C)=C(C)C(C2=C(O)C2C=CC=CC=21)=O)=O
MCULE-1682973743 0.64 C1=C(O)C2C(=O)C(CC/C=C(/C)\C)=CC(=O)C=2C(O)=C1
MCULE-7354436889 0.64 COC1C(C)=C(C(/C=C(\C)/C)=O)C=CC=1
MCULE-6748141498 0.64 OC1=CC=C(C=O)C=C1C/C=C(\C)/C
MCULE-4509512769 0.64 C1(C(C)=O)C(O)=C(C(C)(C)C)C(=C(O)C=1C(C)(C)C)C(C)=O
MolPort-022-377-145 0.64 CC(C)=CCC1=C(O)C=CC(C=O)=C1
MolPort-002-927-195 0.63 CC1=CC(C(=O)\C=C\C(O)=O)=C(C)C=C1
MolPort-002-070-347 0.63 CC1=CC(C)=C(C)C(C(=O)\C=C\C(O)=O)=C1C
MCULE-7321713626 0.63 ClC1C=C(O)C2C(C(=C(C(C=2C=1)=O)Cl)Cl)=O
MCULE-6782518724 0.63 C1(C(=O)C=CC)C(C)=C(C)C=C(C)C=1C
MCULE-6244288085 0.63 C(=O)(/C=C(\C)/C)C1=CC(=CC=C1C)C
MCULE-5319709590 0.63 C1(C(C)=C(C)C=C(C)C=1C)C(=O)/C=C(\C)/C
MCULE-9851872987 0.63 C1(=CC(=CC=C1C)C)C(=O)C=CC
MCULE-1527184568 0.63 CC1C=C(C)C(C(C=CC(O)=O)=O)=C(C)C=1
MCULE-2132021297 0.63 C1(=CC=C(C)C=C1C)C(=O)C=CC(O)=O
MCULE-3974152743 0.63 C(C1C(=C(C)C=C(C)C=1C)C)(=O)C([H])=C([H])C(O)=O
MCULE-8762872566 0.63 C1=CC(C)=CC(C(=O)C=CC(O)=O)=C1C
MCULE-7206694379 0.63 C1C(OC)=C(C(=O)/C=C(\C)/C)C=CC=1C
MCULE-1251772795 0.63 C1=C(O)C2=C(C(=O)C=C(Cl)C2=O)C=C1OC
MCULE-8043271375 0.63 C1C(C=O)=CC(C/C=C(\C)/C)=C(O)C=1C/C=C(\C)/C
MolPort-022-395-162 0.63 COC1=CC2=C(C(O)=C1)C(=O)C(Cl)=CC2=O
MolPort-035-683-174 0.63 CC(C)=CCC1=CC(C=O)=CC(CC=C(C)C)=C1O
MolPort-001-739-498 0.62 C[C@@H]1CCC(=O)[C@H](C)[C@@]1(C)CC\C(C)=C\CC1=C(O)C(C=O)=C(C)C=C1O
MolPort-023-298-954 0.62 CC(C)=CCC1=CC(=CC(C(=O)C=C(C)C)=C1O)C(O)=O
MCULE-2373864375 0.62 C12C(=O)C=CC(=O)C=1C(=CC=C2OC(=O)C(C)(C)C)OC(=O)C(C)(C)C
MCULE-7729380798 0.62 [Na+].C1(C(=O)C=CC([O-])=O)C(C)=C(C)C=C(C)C=1C
MCULE-9929618810 0.62 C1(C(=C(C(O)=CC=1C)C/C=C(\C)/CC[C@]1(C)[C@@H](C)C(CC[C@H]1C)=O)O)C=O
MCULE-3650856367 0.62 C1C(C(=O)O)=CC(C/C=C(\C)/C)=C(O)C=1C(=O)/C=C(\C)/C
MCULE-3914181622 0.62 C(=O)(/C=C(\C)/C)C1C=CC=C(C)C=1C
MCULE-7285887469 0.62 C(=O)(C1=CC=C(C)C(C)=C1)/C=C(\C)/C
MCULE-7684034203 0.62 C1(C=CC=C(C)C=1C)C(=O)C=CC
MCULE-1216502997 0.62 C1(C)C=C(C)C=C(C)C=1C(=O)C=CC
MCULE-8738965458 0.62 C1(=CC=C(C)C(C)=C1)C(=O)C=CC
MCULE-2121418958 0.62 C(=O)(/C=C(\C)/C)C1=CC=C(C)C=C1C
MCULE-6037420437 0.62 C1(=CC=C(C)C=C1C)C(=O)C=CC
MCULE-9299417965 0.62 C(=O)(/C=C(\C)/C)C1C(C)=CC(=CC=1C)C
MCULE-9649368257 0.62 C(=CC(O)=O)C(=O)C1C=CC(=C(C)C=1)C
MCULE-8173536025 0.62 C1(O)=C(C/C=C(\C)/C)C=C(C=C1)C(C)=O
MCULE-3341576745 0.62 C1(C=CC=C(C)C=1C)C(=O)C=CC(O)=O
MCULE-3660757342 0.62 C1(C)C(C(=O)O)=C(O)C(C/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/C)=C(O)C=1
MCULE-5770148238 0.62 C1(C(OC)=O)=CC2C(=O)C=CC(=O)C=2C=C1C(OC)=O
MolPort-001-741-760 0.62 CC(C)=CCC1=CC(=CC=C1O)C(C)=O
MolPort-046-793-323 0.62 CC(C)=CCC\C(C)=C\CC1=C(O)C=C(C)C(C(O)=O)=C1O
MolPort-023-277-209 0.62 CC(C)=CCC\C(C)=C\CC\C(C)=C\CC1=C(O)C=C(C)C(C(O)=O)=C1O
MCULE-8525048591 0.61 C1(C=C(OC)C=CC=1OC)C(=O)C=CC(O)=O
MCULE-6120510683 0.61 C1(C=C(C)C=CC=1OC)C(=O)C=CC
MCULE-8160349189 0.61 C1(C=C(C)C=CC=1OC)C(=O)/C=C(\C)/C
MCULE-3966801527 0.61 C/C(/C)=C/CC1=CC(C=O)=C(O)C=C1
MCULE-6821391898 0.61 C12=CC=CC=C1C(=O)C(=C(C)C2=O)C
MCULE-2487773379 0.61 C1(=O)C2C=CC=CC=2C(C=C1C)=O
MCULE-6963964021 0.61 C1(C=C(O)C=CC=1O)C(=O)C=CC1=CC=CC=C1
MolPort-001-766-699 0.61 CC1=CC(=O)C2=CC=CC=C2C1=O
MolPort-016-582-865 0.61 [2H]C1=C([2H])C2=C(C([2H])=C1[2H])C(=O)C(=C([2H])C2=O)C([2H])([2H])[2H]
MolPort-001-817-681 0.61 CC1=C(C)C(=O)C2=C(C=CC=C2)C1=O
MolPort-001-739-482 0.60 C\C=C\C=C\C(=O)C1=CC(C)=C(O)C(C)=C1O
MolPort-027-720-858 0.60 C[C@]12CC[C@](C)(C[C@H]1[C@]1(C)CC[C@@]3(C)C4=C(C(=O)C=C3[C@@]1(C)CC2)C(C=O)=C(O)C(O)=C4)C(O)=O
MolPort-000-648-454 0.60 CC1=CC=C(\C=C\C(=O)C2=C(O)C=CC(C)=C2)C=C1
MolPort-005-944-157 0.60 CC(C)=CCC1=CC(=CC=C1O)C(O)=O
MCULE-2385467421 0.60 C1(Cl)C(=O)C2C(=CC=CC=2C(=O)C=1Cl)OC(C)=O
MCULE-6605706375 0.60 CC1=C(C(C=CCl)=O)C=CC=C1O
MCULE-2691302870 0.60 C1(C)=C(O)C(C)=CC(C(/C=C/C=C/C)=O)=C1O
MCULE-2643583370 0.60 O1C=CC2=C(O)C3=C(C=C12)C(=O)C=CC3
MCULE-3851740219 0.60 C1(O)=CC2[C@]3(C)CC[C@@]4(C)[C@]5([H])C[C@](C)(C(=O)O)CC[C@]5(C)CC[C@]4(C)C3=CC(=O)C=2C(C=O)=C1O
MCULE-3748073669 0.60 C[C@@]12CC[C@]3(C)C4=CC(=O)C5=C(C=O)C(O)=C(O)C=C5[C@]4(C)CC[C@@]3(C)[C@]1([H])C[C@@](C(O)=O)(C)CC2
MCULE-5242552108 0.60 C1(=CC(=CC=C1OC)OC)C(=O)C=CC
MCULE-7592711305 0.60 C1=CC(C(=O)O)=CC(C/C=C(\C)/C)=C1O
MCULE-4829561028 0.60 C1(=CC(C)=CC=C1O)C(=O)C=CC1C=CC(=CC=1)C
MCULE-5218138483 0.60 C1(=CC(=CC=C1OC)OC)C(=O)/C=C(\C)/C
MCULE-3836924264 0.60 CC1=C(O)C=C(C(C=CCl)=O)C=C1
MCULE-8247700919 0.60 C(=CC(O)=O)C(=O)C1=CC=CC=C1CC
MCULE-5036151620 0.60 C1(O)=C(C=CC=C1C=O)CC=C
MCULE-6434696940 0.60 C(=CC(O)=O)C(=O)C1C=CC=C(OC)C=1
MCULE-9133728392 0.60 C1(=CC(C)=CC=C1O)C(=O)C=CC1C=CC=CC=1