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CHEBI:233432 - 5alpha-Pregnan-3beta-ol-20-one sulfate

ChEBI IDCHEBI:233432
ChEBI Name5alpha-Pregnan-3beta-ol-20-one sulfate
Stars
Submittermwilliams
DownloadsMolfile
FormulaC21H34O5S
Net Charge0
Average Mass398.565
Monoisotopic Mass398.21270
SMILES[H][C@@]12CC[C@]3([H])[C@]([H])(CC[C@@]4(C)[C@@]3([H])CC[C@]4([H])C(C)=O)[C@@]1(C)CC[C@H](OS(=O)(=O)O)C2
InChIInChI=1S/C21H34O5S/c1-13(22)17-6-7-18-16-5-4-14-12-15(26-27(23,24)25)8-10-20(14,2)19(16)9-11-21(17,18)3/h14-19H,4-12H2,1-3H3,(H,23,24,25)/t14-,15-,16-,17+,18-,19-,20-,21+/m0/s1
InChIKeyMENQCIVHHONJLU-FZCSVUEKSA-N
ChEBI Ontology
Outgoing Relation(s)
5alpha-Pregnan-3beta-ol-20-one sulfate (CHEBI:233432) is a steroid sulfate (CHEBI:16158)