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Product Overview

Product Code

TRC-D452410

CAS Number

547-97-7

Product Format

Neat

Molecular Formula

C27 H46 O3

Molecular Weight

418.65

Product Categories

TRC, Lipids, API Reference Standards & Research Materials

Product Type

API

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Product Information

Chemical Data

Analyte Name

7alpha,12alpha-Dihydroxy-5beta-cholestan-3-one

CAS Number

547-97-7

Molecular Formula

C27 H46 O3

Molecular Weight

418.65

Accurate Mass

418.3447

SMILES

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

InChI

InChI=1S/C27H46O3/c1-16(2)7-6-8-17(3)20-9-10-21-25-22(15-24(30)27(20,21)5)26(4)12-11-19(28)13-18(26)14-23(25)29/h16-18,20-25,29-30H,6-15H2,1-5H3/t17-,18+,20-,21+,22+,23-,24+,25+,26+,27-/m1/s1

IUPAC

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

Product Data

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

Product Description

Substrate for 3a-Hydroxysteroid Dehydrogenase in primary bile acid biosynthesis.

References: Berseus, O., et al.: J. Biol. Chem., 240, 2396 (1965), Berseus, O., et al.: Eur. J. Biochem., 2, 503 (1967),

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7Alpha,12Alpha-Dihydroxy-5Beta-cholestan-3-one

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