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CHEBI:22542 - androstane-3,17-dione

ChEBI IDCHEBI:22542
ChEBI Nameandrostane-3,17-dione
Stars
DefinitionAn androstanoid that is androstane substituted by oxo groups at positions 3 and 17.
Last Modified16 September 2021
DownloadsMolfile
FormulaC19H28O2
Net Charge0
Average Mass288.431
Monoisotopic Mass288.20893
SMILES[H][C@@]12CCC3CC(=O)CC[C@]3(C)[C@@]1([H])CC[C@]1(C)C(=O)CC[C@@]21[H]
InChIInChI=1S/C19H28O2/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/h12,14-16H,3-11H2,1-2H3/t12?,14-,15-,16-,18-,19-/m0/s1
InChIKeyRAJWOBJTTGJROA-RNQTWYFASA-N
Wikipedia
Roles Classification
Biological Role:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
androstane-3,17-dione (CHEBI:22542) has role human metabolite (CHEBI:77746)
androstane-3,17-dione (CHEBI:22542) is a 17-oxo steroid (CHEBI:19168)
androstane-3,17-dione (CHEBI:22542) is a 3-oxo steroid (CHEBI:47788)
androstane-3,17-dione (CHEBI:22542) is a androstanoid (CHEBI:50402)
Incoming Relation(s)
5α-androstane-3,17-dione (CHEBI:15994) is a androstane-3,17-dione (CHEBI:22542)
5β-androstane-3,17-dione (CHEBI:16985) is a androstane-3,17-dione (CHEBI:22542)
IUPAC Name 
androstane-3,17-dione
Manual XrefsDatabases
AndrostanedioneWikipedia