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CHEBI:27576 - 19-hydroxyandrost-4-ene-3,17-dione

ChEBI IDCHEBI:27576
ChEBI Name19-hydroxyandrost-4-ene-3,17-dione
Stars
Secondary ChEBI IDsCHEBI:796, CHEBI:19178
Last Modified27 January 2016
DownloadsMolfile
FormulaC19H26O3
Net Charge0
Average Mass302.414
Monoisotopic Mass302.18819
SMILES[H][C@@]12CCC3=CC(=O)CC[C@]3(CO)[C@@]1([H])CC[C@]1(C)C(=O)CC[C@@]21[H]
InChIInChI=1S/C19H26O3/c1-18-8-7-16-14(15(18)4-5-17(18)22)3-2-12-10-13(21)6-9-19(12,16)11-20/h10,14-16,20H,2-9,11H2,1H3/t14-,15-,16-,18-,19+/m0/s1
InChIKeyXGUHPTGEXRHMQQ-BGJMDTOESA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) - PubMed (19425150) Source: BioModels - MODEL1507180067
Roles Classification
Biological Role:
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
ChEBI Ontology
Outgoing Relation(s)
19-hydroxyandrost-4-ene-3,17-dione (CHEBI:27576) has role mouse metabolite (CHEBI:75771)
19-hydroxyandrost-4-ene-3,17-dione (CHEBI:27576) is a 17-oxo steroid (CHEBI:19168)
19-hydroxyandrost-4-ene-3,17-dione (CHEBI:27576) is a 19-hydroxy steroid (CHEBI:36842)
19-hydroxyandrost-4-ene-3,17-dione (CHEBI:27576) is a 3-oxo steroid (CHEBI:47788)
19-hydroxyandrost-4-ene-3,17-dione (CHEBI:27576) is a androstanoid (CHEBI:50402)
IUPAC Name 
19-hydroxyandrost-4-ene-3,17-dione
Synonyms  Source
19-Hydroxyandrost-4-ene-3,17-dioneKEGG COMPOUND
19-HydroxyandrostenedioneKEGG COMPOUND
19-hydroxyandrost-4-ene-3,17-dioneChEBI
19-hydroxyandrostenedioneChEBI
UniProt Name  Source
19-hydroxyandrost-4-ene-3,17-dioneUniProt
Manual XrefsDatabases
C05290KEGG COMPOUND
C05290KEGG COMPOUND
LMST02020067LIPID MAPS
Registry NumbersSources
CAS:510-64-5KEGG COMPOUND