CHEBI:57905 - dehydroepiandrosterone sulfate(1−)

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ChEBI Name dehydroepiandrosterone sulfate(1−)
ChEBI ID CHEBI:57905
ChEBI ASCII Name dehydroepiandrosterone sulfate(1-)
Definition The conjugate base of 3β-hydroxyandrost-5-en-17-one 3-sulfate arising from deprotonation of the sulfate OH group; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C19H27O5S
Net Charge -1
Average Mass 367.481
Monoisotopic Mass 367.15847
InChI InChI=1S/C19H28O5S/c1-18-9-7-13(24-25(21,22)23)11-12(18)3-4-14-15-5-6-17(20)19(15,2)10-8-16(14)18/h3,13-16H,4-11H2,1-2H3,(H,21,22,23)/p-1/t13-,14-,15-,16-,18-,19-/m0/s1
InChIKey CZWCKYRVOZZJNM-USOAJAOKSA-M
SMILES C1[C@@]2([C@@]([C@@]3(C(C[C@@H](OS([O-])(=O)=O)CC3)=C1)C)(CC[C@]4([C@]2(CCC4=O)[H])C)[H])[H]
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) See: DOI
Roles Classification
Biological Role(s): human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
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ChEBI Ontology
Outgoing dehydroepiandrosterone sulfate(1−) (CHEBI:57905) has role human metabolite (CHEBI:77746)
dehydroepiandrosterone sulfate(1−) (CHEBI:57905) is a steroid sulfate oxoanion (CHEBI:59696)
dehydroepiandrosterone sulfate(1−) (CHEBI:57905) is conjugate base of dehydroepiandrosterone sulfate (CHEBI:16814)
Incoming sodium dehydroepiandrosterone sulfate (CHEBI:91028) has part dehydroepiandrosterone sulfate(1−) (CHEBI:57905)
dehydroepiandrosterone sulfate (CHEBI:16814) is conjugate acid of dehydroepiandrosterone sulfate(1−) (CHEBI:57905)
IUPAC Name
17-oxoandrost-5-en-3β-yl sulfate
Synonyms Sources
3β-hydroxyandrost-5-en-17-one 3-sulfate anion ChEBI
3β-hydroxyandrost-5-en-17-one 3-sulfate(1−) ChEBI
3β-sulfooxy-androst-5-en-17-one UniProt
Registry Number Type Source
3916013 Beilstein Registry Number Beilstein
Last Modified
28 January 2016