(2S)-2-[[4-[(2,4-Diamino-5,6,7,8-Tetrahydropteridin-6-Yl)Methyl-Methyl -Amino]Benzoyl]Amino]Pentanedioic Acid
[CAS# 4299-28-9]

Identification

• Name: (2S)-2-[[4-[(2,4-Diamino-5,6,7,8-Tetrahydropteridin-6-Yl)Methyl-Methyl -Amino]Benzoyl]Amino]Pentanedioic Acid
• Synonyms: 2-[[4-[(2,4-Diamino-5,6,7,8-Tetrahydropteridin-6-Yl)Methyl-Methyl-Amino]Benzoyl]Amino]Pentanedioic Acid; 2-[[[4-[(2,4-Diamino-5,6,7,8-Tetrahydropteridin-6-Yl)Methyl-Methylamino]Phenyl]-Oxomethyl]Amino]Pentanedioic Acid; 2-[[4-[(2,4-Diamino-5,6,7,8-Tetrahydropteridin-6-Yl)Methyl-Methyl-Amino]Benzoyl]Amino]Glutaric Acid
• Molecular Formula: C₂₀H₂₆N₈O₅
• Molecular Weight: 458.48
• CAS Registry Number: 4299-28-9
• SMILES: C3=C(N(CC2NC1=C(N=C(N=C1N)N)NC2)C)C=CC(=C3)C(=O)NC(C(=O)O)CCC(=O)O
• InChI: 1S/C20H26N8O5/c1-28(9-11-8-23-17-15(24-11)16(21)26-20(22)27-17)12-4-2-10(3-5-12)18(31)25-13(19(32)33)6-7-14(29)30/h2-5,11,13,24H,6-9H2,1H3,(H,25,31)(H,29,30)(H,32,33)(H5,21,22,23,26,27)
• InChIKey: GLSBTKIRCIEEJO-UHFFFAOYSA-N

Properties

• Density: 1.438g/cm³ (Cal.)