SANC00707 Geodiamolide TA




Analog ID Similarity score SMILES

Selection options

Mcule | MolPort | All | None
MolPort-001-827-707 0.71 CC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC1=CC(I)=C(O)C(I)=C1)C(O)=O
MolPort-001-625-994 0.70 O=C(NCC1CCCO1)C(CC1=CC=CC=C1)N1C(=O)C2C(C3C=CC2C2CC32)C1=O
MolPort-044-865-502 0.70 CC(C)OC(=O)[C@H](CC1=CC=C(O)C=C1)NC(=O)C1CCCC(=O)N1
MCULE-3792201517 0.70 N1(C(CC2=CC=CC=C2)C(=O)NCC2CCCO2)C(=O)C2C(C3C=CC2C2C3C2)C1=O
MCULE-8439465409 0.70 CC(OC([C@@H](NC(C1NC(=O)CCC1)=O)CC1=CC=C(O)C=C1)=O)C
MolPort-002-514-008 0.69 CCCCC[C@@H](O)\C=C\[C@H]1CCC(=O)[C@@H]1CCCCCCC(=O)N[C@@H](CC1=CC=C(O)C=C1)C(=O)OCC
MCULE-6088013378 0.69 C(=O)(C(N)CC1C=CC(=CC=1)O)NC(C)C(=O)NCC(=O)NC(CC(C)C)C(=O)NCC(OCC)=O
MCULE-4822162846 0.69 C(=O)(C(N)CC1C=CC(O)=CC=1)N[C@@]([H])(C)C(=O)NCC(=O)NC(CC(C)C)C(=O)NCC(OCC)=O
MCULE-5858916752 0.69 [C@@]([H])(CC1C=CC(=CC=1)O)(NC(CCCCCC[C@@H]1[C@H](CCC1=O)C=C[C@@H](CCCCC)O)=O)C(OCC)=O
MCULE-8897589295 0.69 C(=O)(C(N)CC1C=CC(=CC=1)O)NC(C)C(=O)NCC(=O)NC(CC(C)C)C(=O)NCC(OCC)=O.Cl
MCULE-1434766263 0.69 [Cl-].C(=O)(C(CC1=CC=C(O)C=C1)[NH3+])N[C@@]([H])(C)C(=O)NCC(=O)NC(CC(C)C)C(=O)NCC(OCC)=O
MCULE-7071709667 0.69 C1(O)C=CC(CC(NC(=O)C(NC(=O)C)([H])CC2C=CC=CC=2)([H])C(=O)OC)=CC=1
MolPort-000-718-691 0.69 [Cl-].CCOC(=O)CNC(=O)C(CC(C)C)NC(=O)CNC(=O)[C@H](C)NC(=O)C([NH3+])CC1=CC=C(O)C=C1
MolPort-009-757-659 0.69 Cl.CCOC(=O)CNC(=O)C(CC(C)C)NC(=O)CNC(=O)[C@H](C)NC(=O)C(N)CC1=CC=C(O)C=C1
MolPort-045-901-938 0.69 Cl.CCOC(=O)CNC(=O)C(CC(C)C)NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1
MolPort-000-559-637 0.69 O=C(C(CC1=CC=CC=C1)N1C(=O)C2C3CC(C=C3)C2C1=O)N1CCOCC1
MolPort-005-898-583 0.68 CCOC(=O)C(CC1=CC(I)=C(O)C(I)=C1)NC(=O)CC
MCULE-1093336829 0.68 N1(C(CC2=CC=CC=C2)C(=O)N2CCOCC2)C(=O)C2C(C3CC2C=C3)C1=O
MCULE-2161130458 0.68 CCOC(C(NC(CC)=O)CC1=CC(I)=C(O)C(I)=C1)=O
MCULE-7336084939 0.68 C1C=C(CC(N)C(=O)NC(C)C(=O)NCC(=O)NC(CC2C=CC=CC=2)C(=O)NC(CC(C)C)C(=O)OCC2C=CC=CC=2)C=CC=1O
MCULE-7359343365 0.68 C(=O)(C(CC1=CC=C(O)C=C1)[NH3+])N[C@@]([H])(C)C(=O)NCC(=O)NC(CC1C=CC=CC=1)C(OC)=O
MCULE-7117801511 0.68 C(=O)([C@]([H])(N)CC1=CC=C(O)C=C1)N[C@@]([H])(C)C(=O)NCC(=O)N[C@@]([H])(CC1C=CC=CC=1)C(OC)=O
MCULE-8558027075 0.68 Cl.C1C=C(CC(N)C(=O)NC(C)C(=O)NCC(=O)NC(CC2C=CC=CC=2)C(=O)NC(CC(C)C)C(=O)OCC2C=CC=CC=2)C=CC=1O
MCULE-7910305356 0.68 C1(CC2C=CC=CC=2)NC(=O)C(C)CC(C)=CC(C)C(O)C(C)=CC(C)C(C(CC)C)OC1=O
MCULE-9193239155 0.68 N1(C(CC2C=CC=CC=2)C(=O)N2CCOCC2)C(=O)C2C(C3C=CC2C2C3C2)C1=O
MolPort-046-697-165 0.68 CCC(C)C1OC(=O)C(CC2=CC=CC=C2)NC(=O)C(C)C\C(C)=C\C(C)C(O)\C(C)=C\C1C
MolPort-001-571-480 0.68 O=C(C(CC1=CC=CC=C1)N1C(=O)C2C(C3C=CC2C2CC32)C1=O)N1CCOCC1
MolPort-000-730-931 0.67 [Cl-].COC(=O)[C@H](CC1=CC=CC=C1)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H]([NH3+])CC1=CC=C(O)C=C1
MolPort-009-757-760 0.67 Cl.COC(=O)[C@H](CC1=CC=CC=C1)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](N)CC1=CC=C(O)C=C1
MolPort-000-711-139 0.67 [Cl-].COC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)[C@H](C)NC(=O)C([NH3+])CC1=CC=C(O)C=C1
MolPort-046-684-359 0.67 COC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC1=CC=CC=C1)NC(=O)CN1CCOCC1
MCULE-8869162793 0.67 [Cl-].C(=O)(C(CC1=CC=C(O)C=C1)[NH3+])N[C@@]([H])(C)C(=O)NCC(=O)NC(CC1C=CC=CC=1)C(OC)=O
MCULE-9989076335 0.67 C(=O)([C@@]([H])(CC1C=CC(O)=CC=1)[NH3+])N[C@@]([H])(C)C(=O)NCC(=O)N[C@@]([H])(CC1=CC=CC=C1)C(OC)=O.[Cl-]
MCULE-8098356729 0.67 [C@]12(C)CC(O)C3C(CCC4=CC(=O)CC[C@]34C)C1CC[C@]2(O)C(=O)COC(CCC(=O)NC(C(C)C)C(=O)NC(CC1C=CC(=CC=1)O)C(OCC)=O)=O
MCULE-1852823983 0.67 C1(O)=C(I)C=C(C=C1I)CC(NC(C)=O)C(OCC)=O
MCULE-3866561671 0.67 C1(I)=C(O)C(I)=CC(=C1)C[C@H](NC(C)=O)C(=O)OCC
MolPort-000-751-882 0.67 CCOC(=O)C(CC1=CC=C(O)C=C1)NC(=O)C(NC(=O)CCC(=O)OCC(=O)[C@@]1(O)CCC2C3CCC4=CC(=O)CC[C@]4(C)C3C(O)C[C@]12C)C(C)C
MolPort-001-834-091 0.67 CCOC(=O)C(CC1=CC(I)=C(O)C(I)=C1)NC(C)=O
MolPort-019-904-245 0.67 CCOC(=O)[C@H](CC1=CC(I)=C(O)C(I)=C1)NC(C)=O
MolPort-002-319-966 0.66 CCOC(=O)C(CC1=CC=C(O)C=C1)NC(=O)C(CC1=CC=CC=C1)NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)OC(C)(C)C
MCULE-9701532199 0.66 C(=O)(C(CC1C=CC=CC=1)NC(=O)C(CC1C=CC=CC=1)NC(CNC(=O)OC(C)(C)C)=O)NC(CC1=CC=C(C=C1)O)C(OCC)=O
MCULE-5886884502 0.66 C(=O)(C(N)CC1=CC=C(C=C1)O)NC(C)C(=O)NCC(=O)NC(C(C)C)C(OC)=O
MCULE-8594872283 0.66 N1(CC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C)C(=O)N[C@@H](C(C)C)C1)CC1C=CC(=CC=1)OC)C(=O)[C@@H]1CCCO1
MCULE-8063092887 0.66 N1(CC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C)C(=O)N[C@@H](C(C)C)C1)CC1C=CC(=CC=1)OC)C(=O)[C@H]1CCCO1
MCULE-1898482093 0.66 [C@@H]1(NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](NC(=O)[C@H](C)NC(=O)[C@@H]([C@@H](C)O)NC(=O)C[C@@H]([C@H](C)CCCCCCCCCC)OC(=O)[C@H](C(C)CC)NC1=O)C)CC1C=CC(O)=CC=1
MCULE-2259860787 0.66 C(=O)([C@@]([H])(CC1=CC=CC=C1)NC(COC1C=CC=CC=1)=O)N[C@]([H])(C)C(=O)N[C@@]([H])(CC(C)C)C(=O)OC(C)(C)C
MCULE-3256949367 0.66 CCOC(C(NC(CNC([C@H](C(C)C)N)=O)=O)CC1C=CC=CC=1)=O
MCULE-1899859190 0.66 C(=O)(C(N)CC1=CC=C(C=C1)O)NC(C)C(=O)NCC(=O)NC(C(C)C)C(OC)=O.Cl
MCULE-7606254665 0.66 C12(CC1)C(=O)NCCOC1=CC=C(C=C1)C[C@@H](C(=O)N[C@@H](C)C(=O)N[C@H](CC1C=CC=CC=1)C(=O)N2)NC(=O)[C@H]1CCCO1
MCULE-9262807242 0.66 C12(CC1)C(=O)NCCOC1=CC=C(C=C1)C[C@@H](C(=O)N[C@@H](C)C(=O)N[C@H](CC1C=CC=CC=1)C(=O)N2)NC(=O)[C@@H]1CCCO1
MolPort-046-556-669 0.66 COC1=CC=C(C[C@@H]2NC(=O)[C@H](CC(C)C)NC(=O)CN(C[C@@H](NC(=O)[C@@H](C)NC2=O)C(C)C)C(=O)[C@H]2CCCO2)C=C1
MolPort-046-567-639 0.66 COC1=CC=C(C[C@@H]2NC(=O)[C@H](CC(C)C)NC(=O)CN(C[C@@H](NC(=O)[C@@H](C)NC2=O)C(C)C)C(=O)[C@@H]2CCCO2)C=C1
MolPort-042-665-792 0.66 CCCCCC(=O)N1CCC[C@H]1C(=O)N[C@@H](CC1=CC=C(O)C=C1)C(=O)OC
MolPort-001-739-543 0.66 CCCCCCCCCC[C@@H](C)[C@@H]1CC(=O)N[C@H]([C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](CC2=CC=C(O)C=C2)C(=O)N[C@@H](C(C)CC)C(=O)O1
MolPort-008-346-770 0.66 CC(C)C[C@H](NC(=O)[C@@H](C)NC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)COC1=CC=CC=C1)C(=O)OC(C)(C)C
MolPort-046-682-877 0.66 OC(=O)C(F)(F)F.COC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCC1=CC=CC=C1
MolPort-016-584-152 0.66 Cl.COC(=O)C(NC(=O)CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)C(C)C
MolPort-046-756-110 0.66 C[C@@H]1NC(=O)[C@H](CC2=CC=C(OCCNC(=O)C3(CC3)NC(=O)[C@@H](CC3=CC=CC=C3)NC1=O)C=C2)NC(=O)[C@@H]1CCCO1
MolPort-046-753-736 0.66 C[C@@H]1NC(=O)[C@H](CC2=CC=C(OCCNC(=O)C3(CC3)NC(=O)[C@@H](CC3=CC=CC=C3)NC1=O)C=C2)NC(=O)[C@H]1CCCO1
MolPort-039-067-884 0.65 CCOC(=O)C(CC1=CC=C(C)C=C1)NC(=O)[C@H]1CCCC(=O)N1
MolPort-039-137-395 0.65 COC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCC1=CC=CC=C1
MolPort-002-515-860 0.65 COC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)C12CC3CC(CC(C3)C1)C2
MolPort-000-655-826 0.65 COC(=O)C(CC1=CC=CC=C1)NC(=O)C(CC1=CC=CC=C1)NC(=O)C12CC3CC(CC(C3)C1)C2
MolPort-019-676-167 0.65 CCOC(=O)C1(CC2=CC=CC=C2C1)NC(=O)C1C(C=C(C)C)C1(C)C
MolPort-006-309-223 0.65 CCOC(=O)C(CC1=CC=C(O)C=C1)NC(=O)C(N)C(C)O
MolPort-046-418-698 0.65 CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CC1=CC=C(O)C=C1)C(O)=O
MolPort-023-276-930 0.65 CC(C)C[C@@H](NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)CC1=CC=C(O)C=C1)C(O)=O
MolPort-003-937-802 0.65 CC(C)C[C@H](NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)CC1=CC=C(O)C=C1)C(O)=O
MolPort-006-133-137 0.65 CC(C)C[C@H](NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)CC1=CC=C(O)C=C1)C(O)=O
MolPort-003-981-151 0.65 CC(C)CC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)CNC(=O)C(N)CC1=CC=C(O)C=C1)C(O)=O
MolPort-019-939-055 0.65 CC(C)C[C@@H](NC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)CNC(=O)CNC(=O)[C@H](N)CC1=CC=C(O)C=C1)C(O)=O
MolPort-002-509-666 0.65 CC(C)C[C@@H](NC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)COC1=CC=CC=C1)C(=O)OC(C)(C)C
MCULE-1402088390 0.65 [C@@H](NC(=O)[C@H](CC(C)C)NC([C@@H](N)CCC1C=CC=CC=1)=O)(C(=O)OC)CC1C=CC=CC=1
MCULE-9753454056 0.65 C12(CC3CC(CC(C3)C1)C2)C(=O)NC(CC1C=CC=CC=1)C(=O)NC(CC1C=CC=CC=1)C(OC)=O
MCULE-7892726165 0.65 CCOC(C1(NC(C2C(C)(C)C2/C=C(\C)/C)=O)CC2=C(C=CC=C2)C1)=O
MCULE-6160145629 0.65 C(N1CCC[C@H]1C(=O)NCC(N1CCC[C@H]1C(=O)N[C@H](C(=O)O)[C@@H](C)CC)=O)(=O)[C@@H](NC([C@@H]1CCCN1C(=O)[C@@H](N)CC1C=CC(O)=CC=1)=O)CC1C=CC=CC=1
MCULE-8979728112 0.65 O=C([C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](NC(=O)[C@H](CC1C=CC(O)=CC=1)N)C)CC1C=CC=CC=1)CC(C)C)O
MCULE-1655109072 0.65 C(C1C=CC(O)=CC=1)[C@@H](N)C(NCC(NCC(N[C@@H](C(N[C@H](CC(C)C)C(O)=O)=O)CC1C=CC=CC=1)=O)=O)=O
MCULE-5427803093 0.65 [C@@H](NC(=O)CNC(=O)CNC(=O)[C@@H](N)CC1C=CC(O)=CC=1)(C(=O)N[C@H](C(=O)O)CC(C)C)CC1C=CC=CC=1
MCULE-5805509131 0.65 [C@@H](NC(=O)CNC(=O)CNC(=O)[C@@H](N)CC1C=CC(O)=CC=1)(C(=O)N[C@H](C(=O)O)CC(C)C)CC1C=CC=CC=1
MCULE-8309387994 0.65 C(O)(=O)[C@H](CC(C)C)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@H](CC1C=CC(O)=CC=1)N
MCULE-5594634883 0.65 C(=O)([C@@]([H])(CC1C=CC=CC=1)NC(COC1=CC=CC=C1)=O)N[C@]([H])(CC(C)C)C(=O)OC(C)(C)C
MCULE-3432643507 0.65 N1(CC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C)C(=O)N[C@@H](C(C)C)C1)CC1C=CC(=CC=1)OC)C(=O)COC(C)C
MCULE-2875827262 0.65 COC(C(NC(CNCC1OCCC1)=O)CC1C=CC=CC=1)=O
MCULE-3312825356 0.65 C1(C(CC)C)C(=O)NC(C(C)C)C(=O)N2CCCC2C(=O)N(C(C(=O)OC(C)C(C(N2CCCC2C(=O)N1)=O)NC(=O)C)CC1C=CC(OC)=CC=1)C
MCULE-6534662802 0.65 CC(=O)NC(CC1C=CC=CC=1)C(=O)NC(CC(C)C)C(OC)=O
MCULE-2777415051 0.65 COC(C(NC(C1CC=CCC1)=O)CC1=CC=C(F)C=C1)=O
MCULE-4020260685 0.65 CCOC(C(NC([C@@H]1NC(=O)CCC1)=O)CC1=CC=C(C)C=C1)=O
MCULE-5819724182 0.65 C(OC)(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CCC1=CC=CC=C1)CC(C)C)CC1=CC=CC=C1
MolPort-046-568-361 0.65 COC1=CC=C(C[C@@H]2NC(=O)[C@H](CC(C)C)NC(=O)CN(C[C@@H](NC(=O)[C@@H](C)NC2=O)C(C)C)C(=O)COC(C)C)C=C1
MolPort-006-668-272 0.65 CCC(C)C1NC(=O)C2CCCN2C(=O)C(NC(C)=O)C(C)OC(=O)C(CC2=CC=C(OC)C=C2)N(C)C(=O)C2CCCN2C(=O)C(NC1=O)C(C)C
MolPort-023-276-020 0.65 CC(C)C[C@H](NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)CNC(=O)[C@@H](CO)NC(=O)[C@@H](N)CC1=CC=C(O)C=C1)C(=O)N[C@@H]([C@@H](C)O)C(O)=O
MolPort-027-921-048 0.65 COC(=O)C(CC1=CC=C(F)C=C1)NC(=O)C1CCC=CC1
MolPort-039-136-626 0.65 CC(C)C[C@H](NC(=O)[C@H](CCC1=CC=CC=C1)NC(=O)CN1CCOCC1)C(=O)N[C@@H](CC1=CC=CC=C1)C(O)=O
MolPort-046-703-437 0.64 CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@]1(C)CCC\C=C\CCC[C@](C)(NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)COCCOCCOCCN)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N1)C(=O)N[C@@H](CCCCN)C(N)=O
MolPort-046-753-426 0.64 COC1=CC=C(C[C@@H]2NC(=O)[C@H](CC3=CC=C(OC[C@H](CC(C)C)NC(=O)CN(CC4CC4)C(=O)[C@@H](C)NC2=O)C=C3)NC(=O)[C@@H]2CCCO2)C=C1
MolPort-046-737-748 0.64 CC(C)C[C@H]1COC2=CC=C(C[C@H](NC(=O)[C@H]3CCCO3)C(=O)N[C@H](C)C(=O)NC3(CC3)C(=O)N[C@H](CC3=CC=CC=C3)C(=O)N1)C=C2
MolPort-046-754-723 0.64 COC1=CC=C(C[C@@H]2NC(=O)[C@H](CC3=CC=C(OC[C@H](CC(C)C)NC(=O)CN(CC4CC4)C(=O)[C@@H](C)NC2=O)C=C3)NC(=O)[C@H]2CCCO2)C=C1
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