CHEBI:133003 - androsterone sulfate(1−)

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ChEBI Name androsterone sulfate(1−)
ChEBI ID CHEBI:133003
ChEBI ASCII Name androsterone sulfate(1-)
Definition A steroid sulfate oxoanion that is the conjugate base of androsterone sulfate, obtained by deprotonation of the sulfo group; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C19H29O5S
Net Charge -1
Average Mass 369.497
Monoisotopic Mass 369.17412
InChI InChI=1S/C19H30O5S/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/h12-16H,3-11H2,1-2H3,(H,21,22,23)/p-1/t12-,13+,14-,15-,16-,18-,19-/m0/s1
InChIKey ZMITXKRGXGRMKS-HLUDHZFRSA-M
SMILES C1[C@@]2([C@@]([C@@]3([C@](C[C@H](OS([O-])(=O)=O)CC3)(C1)[H])C)(CC[C@@]4(C(CC[C@@]24[H])=O)C)[H])[H]
ChEBI Ontology
Outgoing androsterone sulfate(1−) (CHEBI:133003) is a steroid sulfate oxoanion (CHEBI:59696)
androsterone sulfate(1−) (CHEBI:133003) is conjugate base of androsterone sulfate (CHEBI:83037)
Incoming androsterone sulfate (CHEBI:83037) is conjugate acid of androsterone sulfate(1−) (CHEBI:133003)
IUPAC Name
17-oxo-5α-androstan-3α-yl sulfate
Synonyms Sources
(3α,5α)-17-oxoandrostan-3-yl sulfate IUPAC
3α-sulfooxy-5α-androstan-17-one UniProt
androsterone sulfate anion ChEBI
Last Modified
14 June 2019