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Drug Details

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Name:CHEMBL94730
PubChem ID:44327875
Pathway:Show KEGG pathways
InChI:InChI=1S/C42H57N7O8/c1-7-24(5)35-41(56)47-32(20-27-22-43-29-17-13-12-16-28(27)29)39(54)45-31(19-26-14-10-9-11-15-26)38(53)44-30(18-23(3)4)37(52)46-33(21-34(50)51)40(55)48-36(25(6)8-2)42(57)49-35/h9-17,22-25,30-33,35-36,43H,7-8,18-21H2,1-6H3,(H,44,53)(H,45,54)(H,46,52)(H,47,56)(H,48,55)(H,49,57)(H,50,51)/t24-,25-,30-,31+,32-,33+,35?,36?/m0/s1
SMILES:CC[C@@H]([C@H]1NC(=O)[C@@H](NC(=O)[C@@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@@H](NC1=O)Cc1c[nH]c2c1cccc2)Cc1ccccc1)CC(C)C)[C@H](CC)C)C

Properties:
Formula:C42H57N7O8Atoms:57
Molecular Weight:787.944Rotatable Bonds:12
H-bond Acceptors:14H-bond Donors:8
logP:4.4613
Targets:
Synonyms:
CHEBI:255630
CHEMBL94730