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Name:CHEMBL318778
PubChem ID:44327079
Pathway:Show KEGG pathways
InChI:InChI=1S/C53H78N2O12/c1-11-37-24-31(3)23-32(4)25-46(63-9)49-47(64-10)27-34(6)53(61,67-49)50(58)51(59)55-21-14-13-15-41(55)52(60)66-48(35(7)42(56)30-43(37)57)33(5)26-36-16-19-44(45(28-36)62-8)65-39-17-18-40-38(29-39)20-22-54(40)12-2/h17-18,20,22,24,26,29,32,34-37,41-42,44-49,56,61H,11-16,19,21,23,25,27-28,30H2,1-10H3/b31-24-,33-26+/t32-,34-,35-,36+,37-,41?,42+,44-,45-,46+,47+,48-,49?,53-/m1/s1
SMILES:CO[C@@H]1C[C@@H](CC[C@H]1Oc1ccc2c(c1)ccn2CC)/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:C53H78N2O12Atoms:67
Molecular Weight:935.193Rotatable Bonds:9
H-bond Acceptors:14H-bond Donors:2
logP:7.4721
Targets:
NameUniprot IDSourceReferencesInteraction
Calcineurin subunit B type 2CANB2_HUMANBindingDB-shows
Synonyms:
CHEBI:253911
CHEMBL318778
L-70858