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CHEBI:133778 - 1α-hydroxyandrost-4-ene-3,17-dione

Default Structure
ChEBI IDCHEBI:133778
ChEBI Name1α-hydroxyandrost-4-ene-3,17-dione
Stars
ASCII Name1alpha-hydroxyandrost-4-ene-3,17-dione
DefinitionAn androstanoid that is androst-4-ene-3,17-dione in which the hydrogen at the 1α position has been replaced by a hydroxy group.
Last Modified3 March 2017
SubmitterAnne Morgat
DownloadsMolfile
FormulaC19H26O3
Net Charge0
Average Mass302.414
Monoisotopic Mass302.18819
SMILES[H][C@@]12CCC3=CC(=O)C[C@H](O)[C@]3(C)[C@@]1([H])CC[C@]1(C)C(=O)CC[C@@]21[H]
InChIInChI=1S/C19H26O3/c1-18-8-7-15-13(14(18)5-6-16(18)21)4-3-11-9-12(20)10-17(22)19(11,15)2/h9,13-15,17,22H,3-8,10H2,1-2H3/t13-,14-,15-,17-,18-,19-/m0/s1
InChIKeyJVRABWKGNATXPC-HQRJMKCBSA-N
ChEBI Ontology
Outgoing Relation(s)
1α-hydroxyandrost-4-ene-3,17-dione (CHEBI:133778) has functional parent androst-4-ene-3,17-dione (CHEBI:16422)
1α-hydroxyandrost-4-ene-3,17-dione (CHEBI:133778) is a 1-hydroxy steroid (CHEBI:71017)
1α-hydroxyandrost-4-ene-3,17-dione (CHEBI:133778) is a 17-oxo steroid (CHEBI:19168)
1α-hydroxyandrost-4-ene-3,17-dione (CHEBI:133778) is a 3-oxo-Δ4 steroid (CHEBI:47909)
1α-hydroxyandrost-4-ene-3,17-dione (CHEBI:133778) is a androstanoid (CHEBI:50402)
IUPAC Name 
1α-hydroxyandrost-4-ene-3,17-dione
Synonyms  Source
(1α)-1-hydroxyandrost-4-ene-3,17-dioneChEBI
1α-hydroxyandrostenedioneChEBI
UniProt Name  Source
1α-hydroxyandrost-4-ene-3,17-dioneUniProt
Manual XrefsDatabases
CPD-18924MetaCyc
Registry NumbersSources
Reaxys:3155094Reaxys
Citations