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CHEBI:167505 - 5-Dihydrocortisol

ChEBI IDCHEBI:167505
ChEBI Name5-Dihydrocortisol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H32O5
Net Charge0
Average Mass364.482
Monoisotopic Mass364.22497
SMILES[H][C@@]12CC[C@@]3([H])[C@]4([H])CC[C@](O)(C(=O)CO)[C@@]4(C)C[C@H](O)[C@]3([H])[C@@]1(C)CCC(=O)C2
InChIInChI=1S/C21H32O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h12,14-16,18,22,24,26H,3-11H2,1-2H3/t12-,14-,15-,16-,18+,19-,20-,21-/m0/s1
InChIKeyACSFOIGNUQUIGE-SERXDUEGSA-N
Species of MetaboliteComponentSourceComments
unidentified (ncbitaxon:32644) soil (ENVO:00001998) MetaboLights (MTBLS1196) Strain: silty clay loam soil
ChEBI Ontology
Outgoing Relation(s)
5-Dihydrocortisol (CHEBI:167505) is a 21-hydroxy steroid (CHEBI:35344)
IUPAC Name 
(5S,8S,9S,10S,11S,13S,14S,17R)-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-2,4,5,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-3-one
Manual XrefsDatabases
16735853ChemSpider
Registry NumbersSources
CAS:516-41-6ChemIDplus