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CHEBI:87571 - 6β-hydroxyandrost-4-ene-3,17-dione

ChEBI IDCHEBI:87571
ChEBI Name6β-hydroxyandrost-4-ene-3,17-dione
Stars
ASCII Name6beta-hydroxyandrost-4-ene-3,17-dione
DefinitionA 6β-hydroxy steroid that is androst-4-ene-3,17-dione substituted by a β-hydroxy group at position 6.
Last Modified20 August 2015
Submitternhn
DownloadsMolfile
FormulaC19H26O3
Net Charge0
Average Mass302.414
Monoisotopic Mass302.18819
SMILES[H][C@@]12C[C@@H](O)C3=CC(=O)CC[C@]3(C)[C@@]1([H])CC[C@]1(C)C(=O)CC[C@@]21[H]
InChIInChI=1S/C19H26O3/c1-18-7-5-11(20)9-15(18)16(21)10-12-13-3-4-17(22)19(13,2)8-6-14(12)18/h9,12-14,16,21H,3-8,10H2,1-2H3/t12-,13-,14-,16+,18+,19-/m0/s1
InChIKeyWVAMBAWFDOYFOD-DQXCSHPPSA-N
ChEBI Ontology
Outgoing Relation(s)
6β-hydroxyandrost-4-ene-3,17-dione (CHEBI:87571) has functional parent androst-4-ene-3,17-dione (CHEBI:16422)
6β-hydroxyandrost-4-ene-3,17-dione (CHEBI:87571) is a 17-oxo steroid (CHEBI:19168)
6β-hydroxyandrost-4-ene-3,17-dione (CHEBI:87571) is a 3-oxo-Δ4 steroid (CHEBI:47909)
6β-hydroxyandrost-4-ene-3,17-dione (CHEBI:87571) is a 6β-hydroxy steroid (CHEBI:36851)
IUPAC Name 
6β-hydroxyandrost-4-ene-3,17-dione
Synonyms  Source
6β-hydroxyandrostenedioneSUBMITTER
6β-hydroxy-4-androstene-3,17-dioneChEBI
UniProt Name  Source
6β-hydroxyandrost-4-ene-3,17-dioneUniProt
Registry NumbersSources
Reaxys:3121689Reaxys
CAS:63-00-3ChemIDplus
CAS:63-00-3NIST Chemistry WebBook
Citations