Analyte Name

11-Oxo-betamethasone-17-carboxylic Acid

CAS Number

79578-10-2

Molecular Formula

C21 H25 F O5

Molecular Weight

376.419

Accurate Mass

376.169

SMILES

C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)C(=O)C[C@]2(C)[C@@]1(O)C(=O)O

InChI

InChI=1S/C21H25FO5/c1-11-8-15-14-5-4-12-9-13(23)6-7-18(12,2)20(14,22)16(24)10-19(15,3)21(11,27)17(25)26/h6-7,9,11,14-15,27H,4-5,8,10H2,1-3H3,(H,25,26)/t11-,14-,15-,18-,19-,20-,21-/m0/s1

IUPAC

(8S,9R,10S,13S,14S,16S,17R)-9-fluoro-17-hydroxy-10,13,16-trimethyl-3,11-dioxo-7,8,12,14,15,16-hexahydro-6H-cyclopenta[a]phenanthrene-17-carboxylic acid

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat