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Drug Details

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Name:CHEMBL329609
PubChem ID:44327876
Pathway:Show KEGG pathways
InChI:InChI=1S/C50H66N8O9/c1-8-29(5)42(48(65)54-37(45(51)62)25-34-27-52-36-23-17-16-22-35(34)36)58-49(66)43(30(6)9-2)57-47(64)39(26-40(60)61)55-46(63)38(24-28(3)4)56-50(67)44(53-31(7)59)41(32-18-12-10-13-19-32)33-20-14-11-15-21-33/h10-23,27-30,37-39,41-44,52H,8-9,24-26H2,1-7H3,(H2,51,62)(H,53,59)(H,54,65)(H,55,63)(H,56,67)(H,57,64)(H,58,66)(H,60,61)/t29-,30-,37-,38-,39-,42-,43-,44-/m0/s1
SMILES:CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N)Cc1c[nH]c2c1cccc2)[C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C(c1ccccc1)c1ccccc1)NC(=O)C)CC(C)C)CC(=O)O)C

Properties:
Formula:C50H66N8O9Atoms:67
Molecular Weight:923.107Rotatable Bonds:31
H-bond Acceptors:16H-bond Donors:9
logP:6.6152
Targets:
Synonyms:
CHEBI:255631
CHEMBL329609