Ligand Id: 2752
Ligand name 27-hydroxycholesterol

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 2
Rotatable bonds 6
Topological polar surface area 40.46
Molecular weight 402.35
XLogP 8.54
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Summary Biological activity References Structure Similar ligands
Classification
Compound class Metabolite or derivative
IUPAC Name
(3S,8S,9S,10R,13R,14S,17R)-17-[(2R)-7-hydroxy-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
Synonyms
26-hydroxycholesterol
27-OHC
(3β,25​R)-choles​t-5-ene-3​,26-diol
cholest-5​-ene-3,26​-diol, (3​β,25R)-
cholest-5​-ene-3β,26-diol​, (25R)-
Database Links
BindingDB Ligand 20183
CAS Registry No. 20380-11-4
ChEBI CHEBI:17703
ChEMBL Ligand 371018, 387060
Human Metabolome Database HMDB02103
PubChem CID 123976
Search on ChemSpider FYHRJWMENCALJY-CCDZVGGQSA-N
ZINC ZINC04097085, ZINC04097086

Please note: some links may refer to related isomers. For more details please contact: curators@iuphar-db.org