Dehydroepiandrosterone Sulfate-7-Cmo

Analyte Name

Dehydroepiandrosterone Sulfate-7-Cmo

Molecular Formula

C21 H29 N O8 S

Molecular Weight

455.522

Accurate Mass

455.161

SMILES

C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2=O)\C(=N/OCC(=O)O)\C=C4C[C@H](CC[C@]34C)OS(=O)(=O)O

InChI

InChI=1S/C21H29NO8S/c1-20-7-5-13(30-31(26,27)28)9-12(20)10-16(22-29-11-18(24)25)19-14-3-4-17(23)21(14,2)8-6-15(19)20/h10,13-15,19H,3-9,11H2,1-2H3,(H,24,25)(H,26,27,28)/b22-16-/t13-,14-,15-,19-,20-,21-/m0/s1

IUPAC

2-[(E)-[(3S,8R,9S,10R,13S,14S)-10,13-dimethyl-17-oxo-3-sulfooxy-2,3,4,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-7-ylidene]amino]oxyacetic acid

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat