Product Code

TRC-P945945

Product Format

Neat

Molecular Formula

C21 H22 N5 Na O6

Molecular Weight

463.419

API Family

Pemetrexed

Product Categories

TRC, Impurity Reference Materials

Price and availability

48-hour USA dispatch time

Freight restricted.

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Product Information

Chemical Data

Analyte Name

Pemetrexed Sodium Methyl Ester

Molecular Formula

C21 H22 N5 Na O6

Molecular Weight

463.419

Accurate Mass

463.147

SMILES

COC(=O)CC[C@H](NC(=O)c1ccc(CCc2c[nH]c3N=C(N)NC(=O)c23)cc1)C(=O)O[Na]

InChI

InChI=1S/C21H23N5O6.Na/c1-32-15(27)9-8-14(20(30)31)24-18(28)12-5-2-11(3-6-12)4-7-13-10-23-17-16(13)19(29)26-21(22)25-17;/h2-3,5-6,10,14H,4,7-9H2,1H3,(H,24,28)(H,30,31)(H4,22,23,25,26,29);/q;+1/p-1/t14-;/m0./s1

IUPAC

[(2S)-2-[[4-[2-(2-amino-4-oxo-3,7-dihydropyrrolo[2,3-d]pyrimidin-5-yl)ethyl]benzoyl]amino]-5-methoxy-5-oxopentanoyl]oxysodium

Product Data

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

API Family

Pemetrexed

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Pemetrexed Sodium Methyl Ester

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