(2S)-2-[[4-[(2,4-二氨基蝶啶-6-基)甲基-甲基氨基]苯甲酰基]氨基]-4-(2H-四唑-5-基)丁酸
[CAS# 127105-48-0]

基本信息

• 产品名称: (2S)-2-[[4-[(2,4-二氨基蝶啶-6-基)甲基-甲基氨基]苯甲酰基]氨基]-4-(2H-四唑-5-基)丁酸
• 英文名: (2S)-2-[[4-[(2,4-Diaminopteridin-6-Yl)Methyl-Methylamino]Benzoyl]Amino]-4-(2H-Tetrazol-5-Yl)Butanoic Acid
• 别名: (2S)-2-[[4-[(2,4-Diaminopteridin-6-Yl)Methyl-Methyl-Amino]Benzoyl]Amino]-4-(2H-Tetrazol-5-Yl)Butanoic Acid; (2S)-2-[[[4-[(2,4-Diamino-6-Pteridinyl)Methyl-Methylamino]Phenyl]-Oxomethyl]Amino]-4-(2H-Tetrazol-5-Yl)Butanoic Acid; (2S)-2-[[4-[(2,4-Diaminopteridin-6-Yl)Methyl-Methyl-Amino]Benzoyl]Amino]-4-(2H-Tetrazol-5-Yl)Butyric Acid
• 分子式: C₂₀H₂₂N₁₂O₃
• 分子量: 478.47
• CAS 登录号: 127105-48-0
• 分子行输入简码 SMILES: [C@@H](NC(=O)C3=CC=C(N(CC2=NC1=C(N=C(N=C1N=C2)N)N)C)C=C3)(C(=O)O)CCC4=N[NH]N=N4
• 国际化学标识码 InChI: 1S/C20H22N12O3/c1-32(9-11-8-23-17-15(24-11)16(21)26-20(22)27-17)12-4-2-10(3-5-12)18(33)25-13(19(34)35)6-7-14-28-30-31-29-14/h2-5,8,13H,6-7,9H2,1H3,(H,25,33)(H,34,35)(H,28,29,30,31)(H4,21,22,23,26,27)/t13-/m0/s1
• 国际化学标识检索码 InChIKey: WYMVDZHYPSUZLC-ZDUSSCGKSA-N

物理化学性质

• 密度: 1.578g/cm³ （计算值）