N-(4-(2-(2-Amino-1,4-Dihydro-4-Oxopyrido(2,3-d)Pyrimidin-6-Yl)Ethyl)Bezoyl)-L-Glutamic Acid
[CAS# 85597-18-8]

Identification

• Name: N-(4-(2-(2-Amino-1,4-Dihydro-4-Oxopyrido(2,3-d)Pyrimidin-6-Yl)Ethyl)Bezoyl)-L-Glutamic Acid
• Synonyms: (2S)-2-[[[4-[2-(2-Amino-4-Oxo-1H-Pyrido[5,6-E]Pyrimidin-6-Yl)Ethyl]Phenyl]-Oxomethyl]Amino]Pentanedioic Acid; (2S)-2-[[4-[2-(2-Amino-4-Keto-1H-Pyrido[5,6-E]Pyrimidin-6-Yl)Ethyl]Benzoyl]Amino]Glutaric Acid; (2S)-2-[[4-[2-(2-Amino-4-Oxo-1H-Pyrido[5,6-E]Pyrimidin-6-Yl)Ethyl]Phenyl]Carbonylamino]Pentanedioic Acid
• Molecular Formula: C₂₁H₂₁N₅O₆
• Molecular Weight: 439.43
• CAS Registry Number: 85597-18-8
• SMILES: [C@@H](NC(=O)C3=CC=C(CCC2=CN=C1NC(=NC(=O)C1=C2)N)C=C3)(C(=O)O)CCC(=O)O
• InChI: 1S/C21H21N5O6/c22-21-25-17-14(19(30)26-21)9-12(10-23-17)2-1-11-3-5-13(6-4-11)18(29)24-15(20(31)32)7-8-16(27)28/h3-6,9-10,15H,1-2,7-8H2,(H,24,29)(H,27,28)(H,31,32)(H3,22,23,25,26,30)/t15-/m0/s1
• InChIKey: BHDZQFSNQPIPGI-HNNXBMFYSA-N

Properties

• Density: 1.547g/cm³ (Cal.)