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CHEBI:233651 - 3α,17α-dihydroxy-5α-pregnan-11,20-dione

ChEBI IDCHEBI:233651
ChEBI Name3α,17α-dihydroxy-5α-pregnan-11,20-dione
Stars
ASCII Name3alpha,17alpha-dihydroxy-5alpha-pregnan-11,20-dione
DefinitionA C21-steroid that is 5α-pregnane substituted by two α-hydroxy groups at position 3 and 17 and oxo groups at positions 11 and 20.
Last Modified7 March 2025
Submitternhn
DownloadsMolfile
FormulaC21H32O4
Net Charge0
Average Mass348.483
Monoisotopic Mass348.23006
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)CC[C@@H](O)C2
InChIInChI=1S/C21H32O4/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/h13-16,18,23,25H,4-11H2,1-3H3/t13-,14+,15-,16-,18+,19-,20-,21-/m0/s1
InChIKeyAYEXSTRNLGYBSQ-QIUZSYBOSA-N
ChEBI Ontology
Outgoing Relation(s)
3α,17α-dihydroxy-5α-pregnan-11,20-dione (CHEBI:233651) has parent hydride 5α-pregnane (CHEBI:20656)
3α,17α-dihydroxy-5α-pregnan-11,20-dione (CHEBI:233651) is a 11-oxo steroid (CHEBI:47787)
3α,17α-dihydroxy-5α-pregnan-11,20-dione (CHEBI:233651) is a 17α-hydroxy-C21-steroid (CHEBI:138141)
3α,17α-dihydroxy-5α-pregnan-11,20-dione (CHEBI:233651) is a 20-oxo steroid (CHEBI:36885)
3α,17α-dihydroxy-5α-pregnan-11,20-dione (CHEBI:233651) is a 3α-hydroxy steroid (CHEBI:36835)
UniProt Name  Source
3α,17α-dihydroxy-5α-pregnane-11,20-dioneUniProt
Citations