Analyte Name

11Beta,16Alpha,17,21-Tetrahydroxypregna-1,4,14-triene-3,20-dione

CAS Number

131918-73-5

Molecular Formula

C21 H26 O6

Molecular Weight

374.428

Accurate Mass

374.173

SMILES

C[C@]12C=CC(=O)C=C1CC[C@@H]3[C@@H]2[C@@H](O)C[C@@]4(C)C3=C[C@@H](O)[C@]4(O)C(=O)CO

InChI

InChI=1S/C21H26O6/c1-19-6-5-12(23)7-11(19)3-4-13-14-8-16(25)21(27,17(26)10-22)20(14,2)9-15(24)18(13)19/h5-8,13,15-16,18,22,24-25,27H,3-4,9-10H2,1-2H3/t13-,15-,16+,18+,19-,20-,21-/m0/s1

IUPAC

(8R,9S,10R,11S,13S,16R,17S)-11,16,17-trihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-7,8,9,11,12,16-hexahydro-6H-cyclopenta[a]phenanthren-3-one

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Impurity

Product Format

Neat