(4S)-5-[(2S)-2-[[(2S)-4-Amino-1-[[(2S)-6-Imino-1-Oxohexan-2-Yl]Amino]-1,4-Dioxobutan-2-Yl]Carbamoyl]Pyrrolidin-1-Yl]-2-Methyl-4-[(2-Methylpropan-2-Yl)Oxycarbonylamino]-5-Oxopentanoic Acid
[CAS# 134790-35-5]

Identification

• Name: (4S)-5-[(2S)-2-[[(2S)-4-Amino-1-[[(2S)-6-Imino-1-Oxohexan-2-Yl]Amino]-1,4-Dioxobutan-2-Yl]Carbamoyl]Pyrrolidin-1-Yl]-2-Methyl-4-[(2-Methylpropan-2-Yl)Oxycarbonylamino]-5-Oxopentanoic Acid
• Synonyms: (4S)-5-[(2S)-2-[[(1S)-3-Amino-1-[[(1S)-1-Formyl-5-Imino-Pentyl]Carbamoyl]-3-Oxo-Propyl]Carbamoyl]Pyrrolidin-1-Yl]-4-(Tert-Butoxycarbonylamino)-2-Methyl-5-Oxo-Pentanoic Acid; (4S)-5-[(2S)-2-[[[(1S)-3-Amino-1-[[[(1S)-1-Formyl-5-Iminopentyl]Amino]-Oxomethyl]-3-Oxopropyl]Amino]-Oxomethyl]-1-Pyrrolidinyl]-4-[(Tert-Butoxy-Oxomethyl)Amino]-2-Methyl-5-Oxopentanoic Acid; (4S)-5-[(2S)-2-[[(1S)-3-Amino-1-[[(1S)-1-Formyl-5-Imino-Pentyl]Carbamoyl]-3-Keto-Propyl]Carbamoyl]Pyrrolidin-1-Yl]-4-(Tert-Butoxycarbonylamino)-5-Keto-2-Methyl-Valeric Acid
• Molecular Formula: C₂₆H₄₂N₆O₉
• Molecular Weight: 582.65
• CAS Registry Number: 134790-35-5
• SMILES: [C@H](C=O)(NC([C@@H](NC([C@H]1N(CCC1)C([C@@H](NC(=O)OC(C)(C)C)CC(C(=O)O)C)=O)=O)CC(=O)N)=O)CCCC=N
• InChI: 1S/C26H42N6O9/c1-15(24(38)39)12-18(31-25(40)41-26(2,3)4)23(37)32-11-7-9-19(32)22(36)30-17(13-20(28)34)21(35)29-16(14-33)8-5-6-10-27/h10,14-19,27H,5-9,11-13H2,1-4H3,(H2,28,34)(H,29,35)(H,30,36)(H,31,40)(H,38,39)/t15?,16-,17-,18-,19-/m0/s1
• InChIKey: UQLRZTVIEOOQST-WNBKYALVSA-N