(2beta,3beta,5beta,22R)-2,3,14,20,22,25-Hexahydroxycholestan-6-one

Analyte Name

(2beta,3beta,5beta,22R)-2,3,14,20,22,25-Hexahydroxycholestan-6-one

CAS Number

457603-63-3

Molecular Formula

C27 H46 O7

Molecular Weight

482.65

Accurate Mass

482.324

SMILES

CC(C)(O)CCC(O)[C@](C)(O)[C@H]1CC[C@@]2(O)[C@@H]3CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C

InChI

InChI=1S/C27H46O7/c1-23(2,32)9-8-22(31)26(5,33)21-7-11-27(34)16-12-18(28)17-13-19(29)20(30)14-24(17,3)15(16)6-10-25(21,27)4/h15-17,19-22,29-34H,6-14H2,1-5H3/t15-,16+,17-,19+,20-,21-,22?,24+,25+,26+,27+/m0/s1

IUPAC

(2S,3R,5R,8R,9S,10R,13R,14R,17S)-2,3,14-trihydroxy-10,13-dimethyl-17-[(2R)-2,3,6-trihydroxy-6-methylheptan-2-yl]-2,3,4,5,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-6-one

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat