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Product Overview

Product Code

TRC-V087000

CAS Number

1025504-45-3

Product Format

Neat

Molecular Formula

C24 H38 N2 O4

Molecular Weight

418.57

API Family

Tetrabenazine

Product Categories

TRC, Impurity Reference Materials

Product Type

Impurity

Documentation

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Product Information

Chemical Data

Analyte Name

Valbenazine

CAS Number

1025504-45-3

Molecular Formula

C24 H38 N2 O4

Molecular Weight

418.57

Accurate Mass

418.2832

SMILES

COc1cc2CCN3C[C@@H](CC(C)C)[C@@H](C[C@@H]3c2cc1OC)OC(=O)[C@@H](N)C(C)C

InChI

InChI=1S/C24H38N2O4/c1-14(2)9-17-13-26-8-7-16-10-21(28-5)22(29-6)11-18(16)19(26)12-20(17)30-24(27)23(25)15(3)4/h10-11,14-15,17,19-20,23H,7-9,12-13,25H2,1-6H3/t17-,19-,20-,23+/m1/s1

IUPAC

[(2R,3R,11bR)-9,10-dimethoxy-3-(2-methylpropyl)-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-yl] (2S)-2-amino-3-methylbutanoate

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

API Family

Tetrabenazine

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Chemical Data

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Valbenazine (~90% Purity)

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