Analyte Name

(8S,9S,10R,11S,13S,14S,17R)-11-Hydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-7,8,9,10,11,12,13,14,15,17-decahydro-3H-cyclopenta[a]phenanthrene-3,16(6H)-dione

CAS Number

111088-90-5

Molecular Formula

C21H26O6

Molecular Weight

374.43

Accurate Mass

374.17

SMILES

O=C(C1)[C@@](C(CO)=O)(O)[C@]2(C)[C@]1([H])[C@]3([H])CCC4=CC(C=C[C@]4(C)[C@@]3([H])[C@@H](O)C2)=O

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/h5-7,13-15,18,22,24,27H,3-4,8-10H2,1-2H3/t13-,14-,15-,18+,19-,20-,21-/m0/s1

IUPAC

(8S,9S,10R,11S,13S,14S,17S)-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-7,8,9,10,11,12,13,14,15,17-decahydro-3H-cyclopenta[a]phenanthrene-3,16(6H)-dione

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat