Analyte Name

3,12-Dihydroxy-nor-cholanyldiphenylcarbinol

CAS Number

83116-96-5

Molecular Formula

C36 H50 O3

Molecular Weight

530.78

Accurate Mass

530.376

SMILES

C[C@H](CCC(O)(c1ccccc1)c2ccccc2)[C@H]3CC[C@H]4[C@@H]5CCC6CC(O)CC[C@]6(C)[C@H]5CC(O)[C@]34C

InChI

InChI=1S/C36H50O3/c1-24(18-21-36(39,25-10-6-4-7-11-25)26-12-8-5-9-13-26)30-16-17-31-29-15-14-27-22-28(37)19-20-34(27,2)32(29)23-33(38)35(30,31)3/h4-13,24,27-33,37-39H,14-23H2,1-3H3/t24-,27?,28?,29+,30-,31+,32+,33?,34+,35-/m1/s1

IUPAC

(8R,9S,10S,13R,14S,17R)-17-[(2R)-5-hydroxy-5,5-diphenylpentan-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,12-diol

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Impurity

Product Format

Neat