Home
Drugs
Targets
Pathways
Ontologies
Cyp450s
Adv.search
Help/FAQ

Drug Details

add
Name:CHEMBL327590
PubChem ID:44327889
Pathway:Show KEGG pathways
InChI:InChI=1S/C47H69N7O9/c1-12-24(5)40(45(60)52-38(47(62)63)19-31-22-49-35-17-15-14-16-32(31)35)54-46(61)41(25(6)13-2)53-44(59)37(21-39(55)56)51-43(58)36(18-23(3)4)50-42(57)34(48)20-33-29(10)27(8)26(7)28(9)30(33)11/h14-17,22-25,34,36-38,40-41,49H,12-13,18-21,48H2,1-11H3,(H,50,57)(H,51,58)(H,52,60)(H,53,59)(H,54,61)(H,55,56)(H,62,63)/t24-,25-,34-,36-,37-,38-,40-,41-/m0/s1
SMILES:CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1c[nH]c2c1cccc2)[C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1c(C)c(C)c(c(c1C)C)C)N)CC(C)C)CC(=O)O)C

Properties:
Formula:C47H69N7O9Atoms:63
Molecular Weight:876.092Rotatable Bonds:28
H-bond Acceptors:15H-bond Donors:9
logP:6.5988
Targets:
Synonyms:
CHEBI:255651
CHEMBL327590