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

Drug Details

add
Name:L-685818
PubChem ID:44327080
Pathway:Show KEGG pathways
InChI:InChI=1S/C43H69NO13/c1-10-29-18-23(2)37(48)24(3)19-35(54-8)39-36(55-9)20-26(5)43(52,57-39)40(49)41(50)44-16-12-11-13-30(44)42(51)56-38(27(6)32(46)22-33(29)47)25(4)17-28-14-15-31(45)34(21-28)53-7/h17-18,24,26-32,34-39,45-46,48,52H,10-16,19-22H2,1-9H3/b23-18-,25-17+/t24-,26+,27+,28-,29+,30?,31+,32-,34+,35-,36-,37+,38+,39?,43+/m0/s1
SMILES:CC[C@@H]1/C=C(/C)\[C@@H](O)[C@@H](C)C[C@H](OC)C2O[C@](O)([C@@H](C[C@@H]2OC)C)C(=O)C(=O)N2[C@H](C(=O)O[C@@H]([C@@H]([C@H](CC1=O)O)C)/C(=C/[C@@H]1CC[C@H]([C@@H](C1)OC)O)/C)CCCC2

Properties:
Formula:C43H69NO13Atoms:57
Molecular Weight:808.007Rotatable Bonds:6
H-bond Acceptors:14H-bond Donors:4
logP:3.3816
Targets:
NameUniprot IDSourceReferencesInteraction
Calcineurin subunit B type 2CANB2_HUMANBindingDB-shows
Synonyms:
CHEBI:253912
CHEMBL330475
L-685818