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CHEBI:9481 - Tetrahydrocorticosterone

Default Structure
ChEBI IDCHEBI:9481
ChEBI NameTetrahydrocorticosterone
Stars
Last Modified27 January 2016
DownloadsMolfile
FormulaC21H34O4
Net Charge0
Average Mass350.499
Monoisotopic Mass350.24571
SMILES[H][C@]12CC[C@@]3([H])[C@]4([H])CC[C@H](C(=O)CO)[C@@]4(C)C[C@H](O)[C@]3([H])[C@@]1(C)CC[C@@H](O)C2
InChIInChI=1S/C21H34O4/c1-20-8-7-13(23)9-12(20)3-4-14-15-5-6-16(18(25)11-22)21(15,2)10-17(24)19(14)20/h12-17,19,22-24H,3-11H2,1-2H3/t12-,13-,14+,15+,16-,17+,19-,20+,21+/m1/s1
InChIKeyRHQQHZQUAMFINJ-DTDWNVJFSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) urine (BTO:0001419) PubMed (12707870)
Mus musculus (ncbitaxon:10090) - PubMed (19425150) Source: BioModels - MODEL1507180067
ChEBI Ontology
Outgoing Relation(s)
Tetrahydrocorticosterone (CHEBI:9481) is a 21-hydroxy steroid (CHEBI:35344)
Synonyms  Source
1-[(1S,2S,5R,7R,11S,14S,15S,17S)-5,17-dihydroxy-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadecan-14-yl]-2-hydroxyethan-1-oneHMDB
3a,11b,21-Trihydroxy-5b-pregnan-20-oneHMDB
(3a,5b,11b)-3,11,21-trihydroxy-Pregnan-20-oneHMDB
3a,5b-TetrahydrocorticosteroneHMDB
5b-Pregnane-3a,11b,21-triol-20-oneHMDB
TetrahydrocorticosteroneKEGG COMPOUND
Manual XrefsDatabases
C05476KEGG COMPOUND
HMDB0000268HMDB
Registry NumbersSources
CAS:68-42-8KEGG COMPOUND
Citations