17α-hydroxypregnenolone

Ligand id: 5103

Name: 17α-hydroxypregnenolone

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 1
Topological polar surface area 57.53
Molecular weight 332.24
XLogP 3.04
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Metabolite or derivative
IUPAC Name
1-[(1S,2R,5S,10R,11S,14R,15S)-5,14-dihydroxy-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-7-en-14-yl]ethan-1-one
Synonyms
17α hydroxypregnenolone
17-hydroxypregnenolone
17-OH-pregnenolone
Database Links
CAS Registry No. 387-79-1
ChEBI CHEBI:28750
ChEMBL Ligand CHEMBL408706
Human Metabolome Database HMDB00363
Lipid Maps LMST02030089
PubChem CID 91451
RCSB PDB Ligand LZZ
Search Google for chemical match using the InChIKey JERGUCIJOXJXHF-TVWVXWENSA-N
Search Google for chemicals with the same backbone JERGUCIJOXJXHF
Wikipedia 17-alpha-hydroxypregnenolone