Name: Methotrexate-d3 Dimethyl Ester
Brand: TRC
SKU: TRC-M260687

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Product Overview

Product Code

TRC-M260687

CAS Number

432545-60-3

Product Format

Neat

Molecular Formula

C22 2H3 H23 N8 O5

Molecular Weight

485.51

Product Categories

TRC, Stable isotopes, Impurity Reference Materials , API Reference Standards & Research Materials

Product Type

Stable Isotope Labelled, API

Unlabelled CAS Number

34378-65-9

Documentation

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Product Information

Analyte Name

Methotrexate-methyl-d3, Dimethyl Ester

CAS Number

432545-60-3

Molecular Formula

C22 2H3 H23 N8 O5

Molecular Weight

485.51

Accurate Mass

485.2214

SMILES

[2H]C([2H])([2H])N(Cc1cnc2nc(N)nc(N)c2n1)c3ccc(cc3)C(=O)N[C@@H](CCC(=O)OC)C(=O)OC

InChI

InChI=1S/C22H26N8O5/c1-30(11-13-10-25-19-17(26-13)18(23)28-22(24)29-19)14-6-4-12(5-7-14)20(32)27-15(21(33)35-3)8-9-16(31)34-2/h4-7,10,15H,8-9,11H2,1-3H3,(H,27,32)(H4,23,24,25,28,29)/t15-/m0/s1/i1D3

IUPAC

dimethyl (2S)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-(trideuteriomethyl)amino]benzoyl]amino]pentanedioate

Unlabelled CAS Number

34378-65-9

SIL Type

Deuterium

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Stable Isotope Labelled; API

Product Format

Neat

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