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Name:CHEMBL429881
PubChem ID:44327658
Pathway:Show KEGG pathways
InChI:InChI=1S/C53H78N2O13/c1-10-37-24-31(2)23-32(3)25-46(64-8)49-47(65-9)27-34(5)53(62,68-49)50(59)51(60)55-19-12-11-13-41(55)52(61)67-48(35(6)42(57)30-43(37)58)33(4)26-36-14-17-44(45(28-36)63-7)66-39-15-16-40-38(29-39)18-20-54(40)21-22-56/h15-16,18,20,24,26,29,32,34-37,41-42,44-49,56-57,62H,10-14,17,19,21-23,25,27-28,30H2,1-9H3/b31-24-,33-26+/t32-,34-,35-,36+,37-,41?,42+,44-,45-,46+,47+,48-,49?,53-/m1/s1
SMILES:OCCn1ccc2c1ccc(c2)O[C@@H]1CC[C@H](C[C@H]1OC)/C=C(/[C@H]1OC(=O)[C@@H]2CCCCN2C(=O)C(=O)[C@]2(O)OC([C@H](C[C@@H](C/C(=C\[C@H](C(=O)C[C@@H]([C@H]1C)O)CC)/C)C)OC)[C@H](C[C@H]2C)OC)\C

Properties:
Formula:C53H78N2O13Atoms:68
Molecular Weight:951.192Rotatable Bonds:10
H-bond Acceptors:15H-bond Donors:3
logP:6.4445
Targets:
NameUniprot IDSourceReferencesInteraction
Calcineurin subunit B type 2CANB2_HUMANBindingDB-shows
Synonyms:
CHEBI:255172
CHEMBL429881
L-732531