Analyte Name

11beta,17,21-Trihydroxy-16beta-methylpregna-1,4,8-triene-3,20-dione

CAS Number

52092-04-3

Molecular Formula

C22 H28 O5

Molecular Weight

372.455

Accurate Mass

372.194

SMILES

C[C@H]1CC2C3=C([C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO)[C@@]4(C)C=CC(=O)C=C4CC3

InChI

InChI=1S/C22H28O5/c1-12-8-16-15-5-4-13-9-14(24)6-7-20(13,2)19(15)17(25)10-21(16,3)22(12,27)18(26)11-23/h6-7,9,12,16-17,23,25,27H,4-5,8,10-11H2,1-3H3/t12-,16?,17-,20-,21-,22-/m0/s1

IUPAC

(10S,11S,13S,16S,17R)-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13,16-trimethyl-7,11,12,14,15,16-hexahydro-6H-cyclopenta[a]phenanthren-3-one

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat