Analyte Name

17-Hydroxy-3,11-dioxo-androst-4-ene-17beta-carboxylic Acid

CAS Number

3597-44-2

Molecular Formula

C20H26O5

Molecular Weight

346.42

Accurate Mass

346.178

SMILES

C[C@]12CCC(=O)C=C1CC[C@H]3[C@@H]4CC[C@](O)(C(=O)O)[C@@]4(C)CC(=O)[C@H]23

InChI

InChI=1S/C20H26O5/c1-18-7-5-12(21)9-11(18)3-4-13-14-6-8-20(25,17(23)24)19(14,2)10-15(22)16(13)18/h9,13-14,16,25H,3-8,10H2,1-2H3,(H,23,24)/t13-,14-,16+,18-,19-,20-/m0/s1

IUPAC

(8S,9S,10R,13S,14S,17R)-17-hydroxy-10,13-dimethyl-3,11-dioxo-1,2,6,7,8,9,12,14,15,16-decahydrocyclopenta[a]phenanthrene-17-carboxylic acid

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat