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

Drug Details

add
Name:CHEMBL132319
PubChem ID:44355264
Pathway:Show KEGG pathways
InChI:InChI=1S/C35H38N4O16/c40-7-11(8-41)37-39-32(51)22-20-14-3-1-12(44)5-16(14)36-24(20)25-21(23(22)33(39)52)15-4-2-13(45)6-17(15)38(25)34-29(49)28(48)31(19(10-43)53-34)55-35-30(50)27(47)26(46)18(9-42)54-35/h1-6,11,18-19,26-31,34-37,40-50H,7-10H2/t18?,19?,26?,27?,28?,29?,30?,31?,34-,35?/m1/s1
SMILES:OCC(Nn1c(=O)c2c(c1=O)c1c(c3c2c2ccc(cc2n3[C@@H]2OC(CO)C(C(C2O)O)OC2OC(CO)C(C(C2O)O)O)O)[nH]c2c1ccc(c2)O)CO

Properties:
Formula:C35H38N4O16Atoms:55
Molecular Weight:770.693Rotatable Bonds:9
H-bond Acceptors:19H-bond Donors:13
logP:-3.2806
Targets:
Synonyms:
CHEBI:321684
CHEMBL132319