(2S)-2-[[4-[(4-Oxo-1H-Pteridin-6-Yl)Methylamino]Benzoyl]Amino]Pentanedioic Acid
[CAS# 32225-99-3]

Identification

• Name: (2S)-2-[[4-[(4-Oxo-1H-Pteridin-6-Yl)Methylamino]Benzoyl]Amino]Pentanedioic Acid
• Synonyms: (2S)-2-[[Oxo-[4-[(4-Oxo-1H-Pteridin-6-Yl)Methylamino]Phenyl]Methyl]Amino]Pentanedioic Acid; (2S)-2-[[4-[(4-Keto-1H-Pteridin-6-Yl)Methylamino]Benzoyl]Amino]Glutaric Acid; (2S)-2-[[4-[(4-Oxo-1H-Pteridin-6-Yl)Methylamino]Phenyl]Carbonylamino]Pentanedioic Acid
• Molecular Formula: C₁₉H₁₈N₆O₆
• Molecular Weight: 426.39
• CAS Registry Number: 32225-99-3
• SMILES: [C@H](C(=O)O)(NC(C1=CC=C(C=C1)NCC3=NC2=C(NC=NC2=O)N=C3)=O)CCC(=O)O
• InChI: 1S/C19H18N6O6/c26-14(27)6-5-13(19(30)31)25-17(28)10-1-3-11(4-2-10)20-7-12-8-21-16-15(24-12)18(29)23-9-22-16/h1-4,8-9,13,20H,5-7H2,(H,25,28)(H,26,27)(H,30,31)(H,21,22,23,29)/t13-/m0/s1
• InChIKey: ANHVSUORPFCWSR-ZDUSSCGKSA-N

Properties

• Density: 1.611g/cm³ (Cal.)