(2S)-2-[[4-[(2,4-Diaminofuro[5,4-d]Pyrimidin-5-Yl)Methylamino]Benzoyl]Amino]Pentanedioic Acid
[CAS# 156595-84-5]

Identification

• Name: (2S)-2-[[4-[(2,4-Diaminofuro[5,4-d]Pyrimidin-5-Yl)Methylamino]Benzoyl]Amino]Pentanedioic Acid
• Synonyms: (2S)-2-[[[4-[(2,4-Diamino-5-Furo[5,4-D]Pyrimidinyl)Methylamino]Phenyl]-Oxomethyl]Amino]Pentanedioic Acid; (2S)-2-[[4-[(2,4-Diaminofuro[5,4-D]Pyrimidin-5-Yl)Methylamino]Benzoyl]Amino]Glutaric Acid; (2S)-2-[[4-[(2,4-Diaminofuro[5,4-D]Pyrimidin-5-Yl)Methylamino]Phenyl]Carbonylamino]Pentanedioic Acid
• Molecular Formula: C₁₉H₂₀N₆O₆
• Molecular Weight: 428.40
• CAS Registry Number: 156595-84-5
• SMILES: [C@@H](NC(=O)C3=CC=C(NCC1=COC2=C1C(=NC(=N2)N)N)C=C3)(C(=O)O)CCC(=O)O
• InChI: 1S/C19H20N6O6/c20-15-14-10(8-31-17(14)25-19(21)24-15)7-22-11-3-1-9(2-4-11)16(28)23-12(18(29)30)5-6-13(26)27/h1-4,8,12,22H,5-7H2,(H,23,28)(H,26,27)(H,29,30)(H4,20,21,24,25)/t12-/m0/s1
• InChIKey: ACXZKUHGYNILFP-LBPRGKRZSA-N

Properties

• Density: 1.566g/cm³ (Cal.)