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Product Overview

Product Code

TRC-P219535

CAS Number

1391068-12-4

Product Format

Neat

Molecular Formula

C22H25N5O6

Molecular Weight

455.46

Product Categories

P21 Protein Kinase, TRC, Neurotransmission, API Reference Standards & Research Materials

Product Type

API

Documentation

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Product Information

Chemical Data

Analyte Name

D-Pemetrexed Dimethyl Diester

CAS Number

1391068-12-4

Molecular Formula

C22H25N5O6

Molecular Weight

455.46

Accurate Mass

455.1805

SMILES

COC(=O)CC[C@@H](NC(=O)c1ccc(CCc2c[nH]c3NC(=NC(=O)c23)N)cc1)C(=O)OC

InChI

InChI=1S/C22H25N5O6/c1-32-16(28)10-9-15(21(31)33-2)25-19(29)13-6-3-12(4-7-13)5-8-14-11-24-18-17(14)20(30)27-22(23)26-18/h3-4,6-7,11,15H,5,8-10H2,1-2H3,(H,25,29)(H4,23,24,26,27,30)/t15-/m1/s1

IUPAC

dimethyl (2R)-2-[[4-[2-(2-amino-4-oxo-1,7-dihydropyrrolo[2,3-d]pyrimidin-5-yl)ethyl]benzoyl]amino]pentanedioate

Product Data

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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