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CHEBI:233590 - 5α-pregnan-11β-ol-3,20-dione

ChEBI IDCHEBI:233590
ChEBI Name5α-pregnan-11β-ol-3,20-dione
Stars
ASCII Name5alpha-pregnan-11beta-ol-3,20-dione
DefinitionA C21-steroid hormone that is 5α-pregnane substituted by oxo groups at positions 3 and 20 and a β-hydroxy group at position 11. It is a metabolite of progesterone.
Submitternhn
DownloadsMolfile
FormulaC21H32O3
Net Charge0
Average Mass332.484
Monoisotopic Mass332.23514
SMILES[H][C@@]12CC[C@@]3([H])[C@]4([H])CC[C@H](C(C)=O)[C@@]4(C)C[C@H](O)[C@]3([H])[C@@]1(C)CCC(=O)C2
InChIInChI=1S/C21H32O3/c1-12(22)16-6-7-17-15-5-4-13-10-14(23)8-9-20(13,2)19(15)18(24)11-21(16,17)3/h13,15-19,24H,4-11H2,1-3H3/t13-,15-,16+,17-,18-,19+,20-,21+/m0/s1
InChIKeyXHCCPSKYYJBSAA-HFLNPCQSSA-N
ChEBI Ontology
Outgoing Relation(s)
5α-pregnan-11β-ol-3,20-dione (CHEBI:233590) has parent hydride 5α-pregnane (CHEBI:20656)
5α-pregnan-11β-ol-3,20-dione (CHEBI:233590) is a 11β-hydroxy steroid (CHEBI:35346)
5α-pregnan-11β-ol-3,20-dione (CHEBI:233590) is a 20-oxo steroid (CHEBI:36885)
5α-pregnan-11β-ol-3,20-dione (CHEBI:233590) is a 3-oxo-5α-steroid (CHEBI:13601)
5α-pregnan-11β-ol-3,20-dione (CHEBI:233590) is a C21-steroid (CHEBI:61313)
Synonym  Source
11OH-DHP4SUBMITTER
UniProt Name  Source
11β-hydroxy-5α-pregnan-3,20-dioneUniProt
Citations