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Product Overview

Product Code

TRC-F700590

CAS Number

130793-28-1

Product Format

Neat

Molecular Formula

C29 H55 N O6

Molecular Weight

513.7501

API Family

Orlistat

Product Categories

TRC, Impurity Reference Materials , Chiral Molecules , Amino acids

Product Type

Impurity

Documentation

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Product Information

Chemical Data

Analyte Name

(2S,3R,5S)-5-[(N-Formyl-L-leucyl)oxy]-2-hexyl-3-hydroxyhexadecanoic acid

CAS Number

130793-28-1

Molecular Formula

C29 H55 N O6

Molecular Weight

513.7501

Accurate Mass

513.4029

SMILES

CCCCCCCCCCC[C@@H](C[C@@H](O)[C@H](CCCCCC)C(=O)O)OC(=O)[C@H](CC(C)C)NC=O

InChI

InChI=1S/C29H55NO6/c1-5-7-9-11-12-13-14-15-16-18-24(36-29(35)26(30-22-31)20-23(3)4)21-27(32)25(28(33)34)19-17-10-8-6-2/h22-27,32H,5-21H2,1-4H3,(H,30,31)(H,33,34)/t24-,25-,26-,27+/m0/s1

IUPAC

(2S,3R,5S)-5-[(2S)-2-formamido-4-methylpentanoyl]oxy-2-hexyl-3-hydroxyhexadecanoic acid

Product Data

Storage Temperature

-86°C

Shipping Temperature

Dry ice

Country of Origin

CANADA

Product Type

Impurity

Product Format

Neat

API Family

Orlistat

Product Description

A product from thermal and hydrolytic degradation of Orlistat. Orlistat impurity.

References: Stalder, H., et al.:

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(2S,3R,5S)-5-[(N-Formyl-L-leucyl)oxy]-2-hexyl-3-hydroxyhexadecanoic Acid (Orlistat Impurity)

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