CHEBI:89524 - epietiocholanolone

ChEBI IDCHEBI:89524
ChEBI Nameepietiocholanolone
Stars
DefinitionA 3β-hydroxy steroid that is 5β-androstane substituted by a hydroxy group at position 3β and an oxo group at position 17. It is a metabolite of testosterone.
Last Modified7 October 2021
DownloadsMolfile
FormulaC19H30O2
Net Charge0
Average Mass290.447
Monoisotopic Mass290.22458
SMILES[H][C@]12CC[C@]3([H])[C@]([H])(CC[C@]4(C)C(=O)CC[C@@]34[H])[C@@]1(C)CC[C@H](O)C2
InChIInChI=1S/C19H30O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h12-16,20H,3-11H2,1-2H3/t12-,13+,14+,15+,16+,18+,19+/m1/s1
InChIKeyQGXBDMJGAMFCBF-XRJZGPCZSA-N
Wikipedia
Species of MetaboliteComponentSourceComments
Epinephelus fuscoguttatus (ncbitaxon:293821) - DOI (10.1088/1757-899X/515/1/012044)
Homo sapiens (ncbitaxon:9606) blood serum (BTO:0000133) PubMed (17716701)
Mus musculus (ncbitaxon:10090) liver (BTO:0000759) PubMed (1248804)
Roles Classification
Biological Roles:
rat metabolite  Any mammalian metabolite produced during a metabolic reaction in rat (Rattus norvegicus).
human blood serum metabolite  Any metabolite (endogenous or exogenous) found in human blood serum samples.
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
animal metabolite  Any eukaryotic metabolite produced during a metabolic reaction in animals that include diverse creatures from sponges, insects to mammals.
androgen  A sex hormone that stimulates or controls the development and maintenance of masculine characteristics in vertebrates by binding to androgen receptors.
ChEBI Ontology
Outgoing Relation(s)
epietiocholanolone (CHEBI:89524) has parent hydride 5β-androstane (CHEBI:20659)
epietiocholanolone (CHEBI:89524) has role androgen (CHEBI:50113)
epietiocholanolone (CHEBI:89524) has role animal metabolite (CHEBI:75767)
epietiocholanolone (CHEBI:89524) has role human blood serum metabolite (CHEBI:85234)
epietiocholanolone (CHEBI:89524) has role mouse metabolite (CHEBI:75771)
epietiocholanolone (CHEBI:89524) has role rat metabolite (CHEBI:86264)
epietiocholanolone (CHEBI:89524) is a 17-oxo steroid (CHEBI:19168)
epietiocholanolone (CHEBI:89524) is a 3β-hydroxy steroid (CHEBI:36836)
epietiocholanolone (CHEBI:89524) is a androstanoid (CHEBI:50402)
IUPAC Name 
3β-hydroxy-5β-androstan-17-one
Synonyms  Source
(3β,5β)-3-hydroxyandrostan-17-oneChemIDplus
3β-etiocholanoloneChemIDplus
3β-hydroxy-17-oxo-5β-androstaneHMDB
3β-hydroxy-5β-androstane-17-oneHMDB
3β-hydroxyetiocholan-17-oneHMDB
5β-androstan-3β-ol-17-oneHMDB
UniProt Name  Source
3β-hydroxy-5β-androstane-17-oneUniProt
Manual XrefsDatabases
216866ChemSpider
EpietiocholanoloneWikipedia
FDB022109FooDB
HMDB0000546HMDB
LMST02020104LIPID MAPS
Registry NumbersSources
CAS:571-31-3ChemIDplus
CAS:571-31-3NIST Chemistry WebBook
Citations