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:
animal metabolite  Any eukaryotic metabolite produced during a metabolic reaction in animals that include diverse creatures from sponges, insects to mammals.
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).
rat metabolite  Any mammalian metabolite produced during a metabolic reaction in rat (Rattus norvegicus).
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