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Product Overview

Product Code

TRC-K090000

CAS Number

207844-01-7

Product Format

Neat

Molecular Formula

2 C19 H24 N O3 . Ca . 2 H2 O

Molecular Weight

704.91

API Family

Mitiglinide

Product Categories

TRC, API Reference Standards & Research Materials

Product Type

API

Alternate CAS Number

Free base: 145375-43-5

Documentation

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Product Information

Chemical Data

Analyte Name

KAD-1229 Calcium Hydrate

CAS Number

207844-01-7

Molecular Formula

2 C19 H24 N O3 . Ca . 2 H2 O

Molecular Weight

704.91

Accurate Mass

704.335

SMILES

O.O.[Ca+2].[O-]C(=O)[C@H](CC(=O)N1C[C@H]2CCCC[C@H]2C1)Cc3ccccc3.[O-]C(=O)[C@H](CC(=O)N4C[C@H]5CCCC[C@H]5C4)Cc6ccccc6

InChI

InChI=1S/2C19H25NO3.Ca.2H2O/c2*21-18(20-12-15-8-4-5-9-16(15)13-20)11-17(19(22)23)10-14-6-2-1-3-7-14;;;/h2*1-3,6-7,15-17H,4-5,8-13H2,(H,22,23);;2*1H2/q;;+2;;/p-2/t2*15-,16+,17-;;;/m00.../s1

IUPAC

calcium;(2S)-4-[(3aS,7aR)-1,3,3a,4,5,6,7,7a-octahydroisoindol-2-yl]-2-benzyl-4-oxobutanoate;dihydrate

Alternate CAS Number

Free base: 145375-43-5

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

API Family

Mitiglinide

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KAD-1229 Calcium Hydrate

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