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

Drug Details

add
Name:CHEMBL326769
PubChem ID:44344397
Pathway:Show KEGG pathways
InChI:InChI=1S/C30H35NO15S/c1-31-10-9-15(17-6-3-11-47-17)42-14-5-2-4-13-12(14)7-8-16(43-29-22(36)18(32)20(34)25(45-29)27(38)39)24(13)44-30-23(37)19(33)21(35)26(46-30)28(40)41/h2-8,11,15,18-23,25-26,29-37H,9-10H2,1H3,(H,38,39)(H,40,41)/t15-,18?,19?,20?,21?,22?,23?,25?,26?,29?,30?/m0/s1
SMILES:CNCC[C@@H](c1cccs1)Oc1cccc2c1ccc(c2OC1OC(C(=O)O)C(C(C1O)O)O)OC1OC(C(=O)O)C(C(C1O)O)O

Properties:
Formula:C30H35NO15SAtoms:47
Molecular Weight:681.662Rotatable Bonds:12
H-bond Acceptors:17H-bond Donors:9
logP:-0.4362
Targets:
Synonyms:
CHEBI:293317
CHEMBL326769