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CHEBI:233347 - 5alpha-androstan-3alpha,17alpha-diol disulfate

ChEBI IDCHEBI:233347
ChEBI Name5alpha-androstan-3alpha,17alpha-diol disulfate
Stars
Submittermwilliams
DownloadsMolfile
FormulaC19H32O8S2
Net Charge0
Average Mass452.591
Monoisotopic Mass452.15386
SMILES[H][C@@]12CC[C@]3([H])[C@]([H])(CC[C@]4(C)[C@H](OS(=O)(=O)O)CC[C@@]34[H])[C@@]1(C)CC[C@@H](OS(=O)(=O)O)C2
InChIInChI=1S/C19H32O8S2/c1-18-9-7-13(26-28(20,21)22)11-12(18)3-4-14-15-5-6-17(27-29(23,24)25)19(15,2)10-8-16(14)18/h12-17H,3-11H2,1-2H3,(H,20,21,22)(H,23,24,25)/t12-,13+,14-,15-,16-,17+,18-,19-/m0/s1
InChIKeyJHFAETDERBWUOO-CUZKMJQKSA-N
ChEBI Ontology
Outgoing Relation(s)
5alpha-androstan-3alpha,17alpha-diol disulfate (CHEBI:233347) is a steroid sulfate (CHEBI:16158)