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Product Overview

Product Code

TRC-P219503

Product Format

Neat

Molecular Formula

C1513C5H19N5Na2O6 • 7(H2O)

Molecular Weight

476.3471802

API Family

Pemetrexed

Product Categories

TRC, Cancer Research Chemicals and Analytical Standards, P21 Protein Kinase, Neurotransmission, Stable isotopes, Stable Isotope Labelled Analytical Standards, API Reference Standards & Research Materials

Product Type

Stable Isotope Labelled, API

Unlabelled CAS Number

150399-23-8

Documentation

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Product Information

Chemical Data

Analyte Name

Pemetrexed-13C5 Disodium Heptahydrate

Molecular Formula

C1513C5H19N5Na2O6 • 7(H2O)

Molecular Weight

476.3471802

SMILES

O=C1N=C(N)NC2=C1C(CCC3=CC=C(C(N[13C@H]([13C](O[Na])=O)[13CH2][13CH2][13C](O[Na])=O)=O)C=C3)=CN2

InChI

InChI=1S/C20H21N5O6.2Na/c21-20-24-16-15(18(29)25-20)12(9-22-16)6-3-10-1-4-11(5-2-10)17(28)23-13(19(30)31)7-8-14(26)27;;/h1-2,4-5,9,13H,3,6-8H2,(H,23,28)(H,26,27)(H,30,31)(H4,21,22,24,25,29);;/q;2*+1/p-2/t13-;;/m0../s1/i7+1,8+1,13+1,14+1,19+1;;

Unlabelled CAS Number

150399-23-8

SIL Type

Carbon

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Stable Isotope Labelled

Product Format

Neat

API Family

Pemetrexed

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Chemical Data

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