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CHEBI:34135 - 11-Ketoetiocholanolone

ChEBI IDCHEBI:34135
ChEBI Name11-Ketoetiocholanolone
Stars
Last Modified23 October 2015
DownloadsMolfile
FormulaC19H28O3
Net Charge0
Average Mass304.430
Monoisotopic Mass304.20384
SMILES[H][C@]12CC[C@@]3([H])[C@]4([H])CCC(=O)[C@@]4(C)CC(=O)[C@]3([H])[C@@]1(C)CC[C@@H](O)C2
InChIInChI=1S/C19H28O3/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/h11-14,17,20H,3-10H2,1-2H3/t11-,12-,13+,14+,17-,18+,19+/m1/s1
InChIKeyIUNYGQONJQTULL-UKZLPJRTSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) urine (BTO:0001419) PubMed (12707870)
Roles Classification
Biological Role:
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)
11-Ketoetiocholanolone (CHEBI:34135) has role androgen (CHEBI:50113)
11-Ketoetiocholanolone (CHEBI:34135) is a 3-hydroxy steroid (CHEBI:36834)
Incoming Relation(s)
11-ketoetiocholanolone 3-O-(beta-D-glucuronide) (CHEBI:746874) has functional parent 11-Ketoetiocholanolone (CHEBI:34135)
Synonyms  Source
11-KetoetiocholanoloneKEGG COMPOUND
3alpha-Hydroxy-5beta-androstane-11,17-dioneKEGG COMPOUND
(3R,5R,8S,9S,10S,13S,14S)-3-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthrene-11,17-quinoneChEBI
(3R,5R,8S,9S,10S,13S,14S)-10,13-dimethyl-3-oxidanyl-2,3,4,5,6,7,8,9,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthrene-11,17-dioneChEBI
(3R,5R,8S,9S,10S,13S,14S)-3-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthrene-11,17-dioneChEBI
11-OxoaetiocholanoloneHMDB
Manual XrefsDatabases
C14552KEGG COMPOUND
HMDB0006031HMDB
Registry NumbersSources
CAS:739-27-5KEGG COMPOUND
Citations