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CHEBI:233652 - 17α-hydroxy-5α-pregnan-3,11,20-trione

ChEBI IDCHEBI:233652
ChEBI Name17α-hydroxy-5α-pregnan-3,11,20-trione
Stars
ASCII Name17alpha-hydroxy-5alpha-pregnan-3,11,20-trione
DefinitionA C21-steroid that is 5α-pregnane substituted by an α-hydroxy groups at position 17 and oxo groups at positions 3, 11 and 20.
Submitternhn
DownloadsMolfile
FormulaC21H30O4
Net Charge0
Average Mass346.467
Monoisotopic Mass346.21441
SMILES[H][C@@]12CC[C@@]3([H])[C@]4([H])CC[C@](O)(C(C)=O)[C@@]4(C)CC(=O)[C@]3([H])[C@@]1(C)CCC(=O)C2
InChIInChI=1S/C21H30O4/c1-12(22)21(25)9-7-16-15-5-4-13-10-14(23)6-8-19(13,2)18(15)17(24)11-20(16,21)3/h13,15-16,18,25H,4-11H2,1-3H3/t13-,15-,16-,18+,19-,20-,21-/m0/s1
InChIKeyQFXXVTGREOEPLZ-GQPBQRIUSA-N
ChEBI Ontology
Outgoing Relation(s)
17α-hydroxy-5α-pregnan-3,11,20-trione (CHEBI:233652) is a 17α-hydroxy-C21-steroid (CHEBI:138141)
UniProt Name  Source
17α-hydroxy-5α-pregnane-3,11,20-trioneUniProt
Citations