pregnenolone sulfate

Molecular Formula: C₂₁H₃₂O₅S

InChI: InChI=1/C21H32O5S/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/h4,15-19H,5-12H2,1-3H3,(H,23,24,25)/t15-,16-,17+,18-,19-,20-,21+/m0/s1/f/h23H

InChIKey: InChIKey=DIJBBUIOWGGQOP-UZKXBOFGDR
SMILES: [H][C@@]12CC=C3C[C@H](CC[C@]3(C)[C@@]1([H])CC[C@]4(C)[C@H](CC[C@@]24[H])C(C)=O)OS(O)(=O)=O

CAS number 1247-64-9

Names:
    pregnenolone sulfate
    (3S,8S,9S,10R,13S,14S,17S)-17-acetyl-10,13-dimethyl-3-sulfooxy-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene
    (3β)-3-(sulfooxy)pregn-5-en-20-one
    5-pregnen-3β-ol-20-one sulfate

Registries:
    PubChem CID 105074
    Beilstein =2632294
    CAS 1247-64-9 (from NIST)
    ChEBI 35420
    PubChem ID 10233752