Products 64801-58-7

CAS 64801-58-7 is the registry number for Methotrexate-γ-aspartate. Offered by: MedChemExpress. Available pack sizes: Get quote.

Structural formula: {0} (CAS {1})

(2S)-2-[[(4S)-4-carboxy-4-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]butanoyl]amino]butanedioic acid (CAS 64801-58-7) is a chemical compound with the molecular formula C24H27N9O8 and a molecular weight of 569.5 g/mol. IUPAC name: (2S)-2-[[(4S)-4-carboxy-4-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]butanoyl]amino]butanedioic acid. InChIKey: XYYCIYYWAVAWDS-GJZGRUSLSA-N.

Identity
Molecular formulaC24H27N9O8
Molecular weight569.5 g/mol
IUPAC name(2S)-2-[[(4S)-4-carboxy-4-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]butanoyl]amino]butanedioic acid
InChIKeyXYYCIYYWAVAWDS-GJZGRUSLSA-N
SMILESCN(CC1=CN=C2C(=N1)C(=NC(=N2)N)N)C3=CC=C(C=C3)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)O

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