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CHEBI:83865 - androst-5-ene-3,17-dione

Default Structure
ChEBI IDCHEBI:83865
ChEBI Nameandrost-5-ene-3,17-dione
Stars
DefinitionAn androstanoid that is androst-5-ene bearing two oxo substituents at positions 3 and 17.
Last Modified24 October 2018
Submitternhn
DownloadsMolfile
FormulaC19H26O2
Net Charge0
Average Mass286.415
Monoisotopic Mass286.19328
SMILES[H][C@@]12CC=C3CC(=O)CC[C@]3(C)[C@@]1([H])CC[C@]1(C)C(=O)CC[C@@]21[H]
InChIInChI=1S/C19H26O2/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/h3,14-16H,4-11H2,1-2H3/t14-,15-,16-,18-,19-/m0/s1
InChIKeySQGZFRITSMYKRH-QAGGRKNESA-N
ChEBI Ontology
Outgoing Relation(s)
androst-5-ene-3,17-dione (CHEBI:83865) is a 17-oxo steroid (CHEBI:19168)
androst-5-ene-3,17-dione (CHEBI:83865) is a 3-oxo-Δ5-steroid (CHEBI:47907)
androst-5-ene-3,17-dione (CHEBI:83865) is a androstanoid (CHEBI:50402)
IUPAC Name 
androst-5-ene-3,17-dione
Synonyms  Source
5-androstene-3,17-dioneSUBMITTER
delta5-Androstene-3,17-dioneChemIDplus
Δ5-androstene-3,17-dioneChEBI
UniProt Name  Source
androst-5-ene-3,17-dioneUniProt
Manual XrefsDatabases
C20252KEGG COMPOUND
CPD66-29MetaCyc
Registry NumbersSources
Reaxys:2336399Reaxys
CAS:571-36-8ChemIDplus
Citations