N-[4-[[1-(2,4-Diamino-6-Pteridinyl)Ethyl]Methylamino]Benzoyl]-L-Glutamic Acid
[CAS# 25663-23-4]

Identification

• Name: N-[4-[[1-(2,4-Diamino-6-Pteridinyl)Ethyl]Methylamino]Benzoyl]-L-Glutamic Acid
• Synonyms: (2S)-2-[[4-[1-(2,4-Diaminopteridin-6-Yl)Ethyl-Methyl-Amino]Benzoyl]Amino]Pentanedioic Acid; (2S)-2-[[[4-[1-(2,4-Diamino-6-Pteridinyl)Ethyl-Methylamino]Phenyl]-Oxomethyl]Amino]Pentanedioic Acid; (2S)-2-[[4-[1-(2,4-Diaminopteridin-6-Yl)Ethyl-Methyl-Amino]Benzoyl]Amino]Glutaric Acid
• Molecular Formula: C₂₁H₂₄N₈O₅
• Molecular Weight: 468.47
• CAS Registry Number: 25663-23-4
• SMILES: [C@@H](NC(=O)C3=CC=C(N(C(C2=CN=C1N=C(N=C(N)C1=N2)N)C)C)C=C3)(C(=O)O)CCC(=O)O
• InChI: 1S/C21H24N8O5/c1-10(14-9-24-18-16(25-14)17(22)27-21(23)28-18)29(2)12-5-3-11(4-6-12)19(32)26-13(20(33)34)7-8-15(30)31/h3-6,9-10,13H,7-8H2,1-2H3,(H,26,32)(H,30,31)(H,33,34)(H4,22,23,24,27,28)/t10?,13-/m0/s1
• InChIKey: PDZWMZKEQIIYKL-HQVZTVAUSA-N

Properties

• Density: 1.497g/cm³ (Cal.)