(6alpha)-17,21-Dihydroxy-6-methylpregna-1,4,9(11)-triene-3,20-dione

Analyte Name

(6alpha)-17,21-Dihydroxy-6-methylpregna-1,4,9(11)-triene-3,20-dione

CAS Number

93269-35-3

Molecular Formula

C22 H28 O4

Molecular Weight

356.46

Accurate Mass

356.1988

SMILES

C[C@H]1C[C@H]2[C@@H]3CC[C@](O)(C(=O)CO)[C@@]3(C)CC=C2[C@@]4(C)C=CC(=O)C=C14

InChI

InChI=1S/C22H28O4/c1-13-10-15-16(20(2)7-4-14(24)11-18(13)20)5-8-21(3)17(15)6-9-22(21,26)19(25)12-23/h4-5,7,11,13,15,17,23,26H,6,8-10,12H2,1-3H3/t13-,15+,17-,20+,21-,22-/m0/s1

IUPAC

(6S,8S,10R,13S,14S,17R)-17-hydroxy-17-(2-hydroxyacetyl)-6,10,13-trimethyl-7,8,12,14,15,16-hexahydro-6H-cyclopenta[a]phenanthren-3-one

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Metabolite

Product Format

Neat

API Family

Prednisolone

Purity

>95% (HPLC)