异亮氨酰-组氨酰-亮氨酰-缬氨酰-脯氨酰-羧基酰胺基甲基半胱氨酰-精氨酸
[CAS# 137593-44-3]

基本信息

• 产品名称: 异亮氨酰-组氨酰-亮氨酰-缬氨酰-脯氨酰-羧基酰胺基甲基半胱氨酰-精氨酸
• 英文名: Isoleucyl-histidyl-leucyl-valyl-prolyl-carboxyamidomethylcysteinyl-arginine
• 别名: (2S)-2-[[(2R)-2-[[(2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S,3S)-2-Amino-3-Methyl-Pentanoyl]Amino]-3-(3H-Imidazol-4-Yl)Propanoyl]Amino]-4-Methyl-Pentanoyl]Amino]-3-Methyl-Butanoyl]Pyrrolidine-2-Carbonyl]Amino]-3-(2-Amino-2-Oxo-Ethyl)Sulfanyl-Propanoyl]Amino]-5-Guanidino-Pentanoic Acid; (2S)-2-[[(2R)-2-[[[(2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S,3S)-2-Amino-3-Methyl-1-Oxopentyl]Amino]-3-(3H-Imidazol-4-Yl)-1-Oxopropyl]Amino]-4-Methyl-1-Oxopentyl]Amino]-3-Methyl-1-Oxobutyl]-2-Pyrrolidinyl]-Oxomethyl]Amino]-3-[(2-Amino-2-Oxoethyl)Thio]-1-Oxopropyl]Amino]-5-Guanidinopentanoic Acid; (2S)-2-[[(2R)-3-[(2-Amino-2-Keto-Ethyl)Thio]-2-[[(2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S,3S)-2-Amino-3-Methyl-Pentanoyl]Amino]-3-(3H-Imidazol-4-Yl)Propanoyl]Amino]-4-Methyl-Pentanoyl]Amino]-3-Methyl-Butanoyl]Pyrrolidine-2-Carbonyl]Amino]Propanoyl]Amino]-5-Guanidino-Valeric Acid
• 分子式: C₃₉H₆₇N₁₃O₉S
• 分子量: 894.10
• CAS 登录号: 137593-44-3
• 分子行输入简码 SMILES: [C@@H]1(N(CCC1)C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](N)[C@H](CC)C)CC2=CN=C[NH]2)CC(C)C)C(C)C)C(=O)N[C@@H](CSCC(=O)N)C(=O)N[C@@H](CCCN=C(N)N)C(O)=O
• 国际化学标识码 InChI: 1S/C39H67N13O9S/c1-7-22(6)30(41)36(58)49-26(15-23-16-44-19-46-23)32(54)48-25(14-20(2)3)33(55)51-31(21(4)5)37(59)52-13-9-11-28(52)35(57)50-27(17-62-18-29(40)53)34(56)47-24(38(60)61)10-8-12-45-39(42)43/h16,19-22,24-28,30-31H,7-15,17-18,41H2,1-6H3,(H2,40,53)(H,44,46)(H,47,56)(H,48,54)(H,49,58)(H,50,57)(H,51,55)(H,60,61)(H4,42,43,45)/t22-,24-,25-,26-,27-,28-,30-,31-/m0/s1
• 国际化学标识检索码 InChIKey: HUZMMLMUHRPCRT-QKDPGABGSA-N

物理化学性质

• 密度: 1.439g/cm³ （计算值）