CHEBI:34133 - 11-oxotestosterone

ChEBI IDCHEBI:34133
ChEBI Name11-oxotestosterone
Stars
DefinitionA 3-oxo Δ4-steroid that is testosterone carrying an additional oxo substituent at position 11.
Last Modified4 July 2017
DownloadsMolfile
FormulaC19H26O3
Net Charge0
Average Mass302.414
Monoisotopic Mass302.18819
SMILES[H][C@@]12CCC3=CC(=O)CC[C@]3(C)[C@@]1([H])C(=O)C[C@]1(C)[C@@H](O)CC[C@@]21[H]
InChIInChI=1S/C19H26O3/c1-18-8-7-12(20)9-11(18)3-4-13-14-5-6-16(22)19(14,2)10-15(21)17(13)18/h9,13-14,16-17,22H,3-8,10H2,1-2H3/t13-,14-,16-,17+,18-,19-/m0/s1
InChIKeyWTPMRQZHJLJSBO-XQALERBDSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - PubMed (27428878)
Kryptolebias marmoratus (ncbitaxon:37003) - PubMed (27750118)
Clarias batrachus (ncbitaxon:59899) - PubMed (28666831)
Danio rerio (ncbitaxon:7955) - PubMed (27927697)
Sparus aurata (ncbitaxon:8175) - PubMed (28095297)
Astyanax altiparanae (ncbitaxon:142828) - PubMed (27025723)
Pollachius virens (ncbitaxon:8060) - PubMed (27734466)
Lamprologus callipterus (ncbitaxon:32501) - PubMed (27852761)
Amatitlania siquia (ncbitaxon:1537670) - PubMed (27793721)
Epinephelus marginatus (ncbitaxon:179535) - PubMed (28652135)
Hippocampus erectus (ncbitaxon:109281) - PubMed (28197868)
Acipenser ruthenus (ncbitaxon:7906) - PubMed (28109018)
Oreochromis niloticus (ncbitaxon:8128) - PubMed (27044511)
Anguilla australis (ncbitaxon:7940) - PubMed (26764051)
Oryzias latipes (ncbitaxon:8090) - PubMed (28279673)
Helicolenus dactylopterus (ncbitaxon:202727) - PubMed (28321875)
Roles Classification
Biological Roles:
androgen  A sex hormone that stimulates or controls the development and maintenance of masculine characteristics in vertebrates by binding to androgen receptors.
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
marine xenobiotic metabolite  Any metabolite produced by metabolism of a xenobiotic compound in marine macro- and microorganisms.
ChEBI Ontology
Outgoing Relation(s)
11-oxotestosterone (CHEBI:34133) has functional parent testosterone (CHEBI:17347)
11-oxotestosterone (CHEBI:34133) has parent hydride androstane (CHEBI:35509)
11-oxotestosterone (CHEBI:34133) has role androgen (CHEBI:50113)
11-oxotestosterone (CHEBI:34133) has role human metabolite (CHEBI:77746)
11-oxotestosterone (CHEBI:34133) has role marine xenobiotic metabolite (CHEBI:83399)
11-oxotestosterone (CHEBI:34133) is a 11-oxo steroid (CHEBI:47787)
11-oxotestosterone (CHEBI:34133) is a 17β-hydroxy steroid (CHEBI:35343)
11-oxotestosterone (CHEBI:34133) is a 3-oxo-Δ4 steroid (CHEBI:47909)
11-oxotestosterone (CHEBI:34133) is a androstanoid (CHEBI:50402)
IUPAC Name 
17β-hydroxyandrost-4-ene-3,11-dione
Synonyms  Source
11-Keto-testosteroneKEGG COMPOUND
17beta-Hydroxyandrost-4-ene-3,11-dioneKEGG COMPOUND
11-KetotestosteroneChemIDplus
(17β)-17-hydroxyandrost-4-ene-3,11-dioneIUPAC
UniProt Name  Source
17β-hydroxyandrost-4-ene-3,11-dioneUniProt
Manual XrefsDatabases
C14256KEGG COMPOUND
CPD-13749MetaCyc
Registry NumbersSources
Reaxys:3153665Reaxys
CAS:564-35-2KEGG COMPOUND
CAS:564-35-2ChemIDplus
Citations