Analyte Name

17Alpha-Dihydroequilenin Sodium Sulfate

CAS Number

56086-66-9

Molecular Formula

C18 H19 O5 S . Na

Molecular Weight

370.395

Accurate Mass

370.085

SMILES

[Na+].C[C@]12CCc3c(ccc4cc(OS(=O)(=O)[O-])ccc34)[C@@H]1CC[C@H]2O

InChI

InChI=1S/C18H20O5S.Na/c1-18-9-8-14-13-5-3-12(23-24(20,21)22)10-11(13)2-4-15(14)16(18)6-7-17(18)19;/h2-5,10,16-17,19H,6-9H2,1H3,(H,20,21,22);/q;+1/p-1/t16-,17+,18-;/m0./s1

IUPAC

sodium;[(13S,14S,17R)-17-hydroxy-13-methyl-11,12,14,15,16,17-hexahydrocyclopenta[a]phenanthren-3-yl] sulfate

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat