(4S)-4-氨基-5-[[(2S)-1-[[(2S)-1-[[2-[[(2S)-1-[[(2S)-1-氨基-4-甲硫基-1-氧代丁烷-2-基]氨基]-4-甲基-1-氧代戊烷-2-基]氨基]-2-氧代乙基]氨基]-1-氧代-3-苯基丙烷-2-基]氨基]-1-氧代-3-苯基丙烷-2-基]氨基]-5-氧代戊酸
[CAS# 123067-53-8]

基本信息

• 产品名称: (4S)-4-氨基-5-[[(2S)-1-[[(2S)-1-[[2-[[(2S)-1-[[(2S)-1-氨基-4-甲硫基-1-氧代丁烷-2-基]氨基]-4-甲基-1-氧代戊烷-2-基]氨基]-2-氧代乙基]氨基]-1-氧代-3-苯基丙烷-2-基]氨基]-1-氧代-3-苯基丙烷-2-基]氨基]-5-氧代戊酸
• 英文名: (4S)-4-Amino-5-[[(2S)-1-[[(2S)-1-[[2-[[(2S)-1-[[(2S)-1-Amino-4-Methylsulfanyl-1-Oxobutan-2-Yl]Amino]-4-Methyl-1-Oxopentan-2-Yl]Amino]-2-Oxoethyl]Amino]-1-Oxo-3-Phenylpropan-2-Yl]Amino]-1-Oxo-3-Phenylpropan-2-Yl]Amino]-5-Oxopentanoic Acid
• 别名: (4S)-4-Amino-5-[[(1S)-1-(Benzyl)-2-[[(1S)-1-(Benzyl)-2-[[2-[[(1S)-1-[[(1S)-1-Carbamoyl-3-(Methylthio)Propyl]Carbamoyl]-3-Methyl-Butyl]Amino]-2-Keto-Ethyl]Amino]-2-Keto-Ethyl]Amino]-2-Keto-Ethyl]Amino]-5-Keto-Valeric Acid; (4S)-4-Amino-5-[[(1S)-2-[[(1S)-2-[[2-[[(1S)-1-[[(1S)-1-Carbamoyl-3-Methylsulfanyl-Propyl]Carbamoyl]-3-Methyl-Butyl]Amino]-2-Oxo-Ethyl]Amino]-2-Oxo-1-(Phenylmethyl)Ethyl]Amino]-2-Oxo-1-(Phenylmethyl)Ethyl]Amino]-5-Oxo-Pentanoic Acid; (4S)-4-Amino-5-[[(1S)-2-[[(1S)-2-[[2-[[(1S)-1-[[[(1S)-1-Carbamoyl-3-(Methylthio)Propyl]Amino]-Oxomethyl]-3-Methylbutyl]Amino]-2-Oxoethyl]Amino]-2-Oxo-1-(Phenylmethyl)Ethyl]Amino]-2-Oxo-1-(Phenylmethyl)Ethyl]Amino]-5-Oxopentanoic Acid
• 分子式: C₃₆H₅₁N₇O₈S
• 分子量: 741.90
• CAS 登录号: 123067-53-8
• 分子行输入简码 SMILES: [C@@H](NC(=O)[C@@H](N)CCC(=O)O)(C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N)CCSC)CC(C)C)CC1=CC=CC=C1)CC2=CC=CC=C2
• 国际化学标识码 InChI: 1S/C36H51N7O8S/c1-22(2)18-27(35(50)41-26(32(38)47)16-17-52-3)40-30(44)21-39-34(49)28(19-23-10-6-4-7-11-23)43-36(51)29(20-24-12-8-5-9-13-24)42-33(48)25(37)14-15-31(45)46/h4-13,22,25-29H,14-21,37H2,1-3H3,(H2,38,47)(H,39,49)(H,40,44)(H,41,50)(H,42,48)(H,43,51)(H,45,46)/t25-,26-,27-,28-,29-/m0/s1
• 国际化学标识检索码 InChIKey: QUPMCECAIWKMMD-ZIUUJSQJSA-N

物理化学性质

• 密度: 1.255g/cm³ （计算值）
• 沸点: 1178.391°C at 760 mmHg （计算值）
• 闪点: 666.467°C （计算值）