3-β-hydroxyandrost-5-en-17-one 3-sulfate

Chemical Formula:

C₁₉H₂₇O₅S

Molecular Weight:

367.479 Daltons

Monoisotopic Mass:

368.1657446993 Daltons

SMILES:

CC24(CCC(CC(=CC[CH]1([CH]3(CCC(=O)C(C)(CC[CH]12)3)))4)OS(=O)(=O)[O-])

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

Databases

MetaCyc: BETA-HYDROXYANDROST-5-EN-17-ONE-3-SULFAT

RefMet: Dehydroepiandrosterone sulfate

ChEBI: 57905

PubChem (CID): 20057076 12594

HMDB: HMDB01032

KEGG: C04555

Seed: cpd02774

MetaNetX: MNXM991