CHEBI:22542 - androstane-3,17-dione

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ChEBI Name androstane-3,17-dione
ChEBI ID CHEBI:22542
Definition An androstanoid that is androstane substituted by oxo groups at positions 3 and 17.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C19H28O2
Net Charge 0
Average Mass 288.42440
Monoisotopic Mass 288.20893
InChI InChI=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
InChIKey RAJWOBJTTGJROA-RNQTWYFASA-N
SMILES C[C@]12CC[C@H]3[C@@H](CCC4CC(=O)CC[C@]34C)[C@@H]1CCC2=O
Roles Classification
Biological Role(s): human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
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ChEBI Ontology
Outgoing 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 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 Xref Database
Androstanedione Wikipedia
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Last Modified
07 May 2014