Diazoketone methotrexate

cas: 82972-54-1 — see every product listed under this CAS number, including other names

Diazoketone methotrexate (CAS 82972-54-1) is a chemical reagent available from Chemat. Available pack sizes: Get quote. Offered by: MedChemExpress.

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cas82972-54-1
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(2S)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-6-diazo-5-oxohexanoic acid (CAS 82972-54-1) is a chemical compound with the molecular formula C21H22N10O4 and a molecular weight of 478.5 g/mol. IUPAC name: (2S)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-6-diazo-5-oxohexanoic acid. InChIKey: DUYMESGXUXXYQB-HNNXBMFYSA-N.

Identity
Molecular formulaC21H22N10O4
Molecular weight478.5 g/mol
IUPAC name(2S)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-6-diazo-5-oxohexanoic acid
InChIKeyDUYMESGXUXXYQB-HNNXBMFYSA-N
SMILESCN(CC1=CN=C2C(=N1)C(=NC(=N2)N)N)C3=CC=C(C=C3)C(=O)N[C@@H](CCC(=O)C=[N+]=[N-])C(=O)O

Computed by PubChem (NCBI)

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