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CHEBI:62117 - 6β-hydroxyprogesterone

ChEBI IDCHEBI:62117
ChEBI Name6β-hydroxyprogesterone
Stars
ASCII Name6beta-hydroxyprogesterone
DefinitionA 3-oxo-Δ4-steroid that is progesterone in which the hydrogen at the 6β-position is substituted by a hydroxy group.
Last Modified29 September 2016
SubmitterGareth Owen
DownloadsMolfile
FormulaC21H30O3
Net Charge0
Average Mass330.468
Monoisotopic Mass330.21949
SMILES[H][C@@]12C[C@@H](O)C3=CC(=O)CC[C@]3(C)[C@@]1([H])CC[C@]1(C)[C@@H](C(C)=O)CC[C@@]21[H]
InChIInChI=1S/C21H30O3/c1-12(22)15-4-5-16-14-11-19(24)18-10-13(23)6-8-21(18,3)17(14)7-9-20(15,16)2/h10,14-17,19,24H,4-9,11H2,1-3H3/t14-,15+,16-,17-,19+,20+,21+/m0/s1
InChIKeyPWCLWZOSAFOXFL-CXICGXRGSA-N
ChEBI Ontology
Outgoing Relation(s)
6β-hydroxyprogesterone (CHEBI:62117) is a 20-oxo steroid (CHEBI:36885)
6β-hydroxyprogesterone (CHEBI:62117) is a 3-oxo-Δ4 steroid (CHEBI:47909)
6β-hydroxyprogesterone (CHEBI:62117) is a 6β-hydroxy steroid (CHEBI:36851)
Incoming Relation(s)
6β-hydroxyprogesterone hemisuccinate (CHEBI:62116) has functional parent 6β-hydroxyprogesterone (CHEBI:62117)
IUPAC Name 
(6β)-6-hydroxypregn-4-ene-3,20-dione
Synonyms  Source
3,20-dioxopregn-4-en-6β-olChEBI
6β-hydroxy-4-pregnen-3,20-dioneChEBI
6β-hydroxy-4-pregnene-3,20-dioneChEBI
6β-hydroxydeoxycorticosteroneChEBI
UniProt Name  Source
6β-hydroxyprogesteroneUniProt
Registry NumbersSources
Reaxys:3218996Reaxys
CAS:604-19-3ChemIDplus