(4S)-4-Amino-5-[[(2S)-6-Amino-1-[[(2S)-1-[[(2S,3S)-1-[[(2S)-1,3-Dihydroxy-1-Oxopropan-2-Yl]Amino]-3-Methyl-1-Oxopentan-2-Yl]Amino]-3-Methyl-1-Oxobutan-2-Yl]Amino]-1-Oxohexan-2-Yl]Amino]-5-Oxopentanoic Acid
[CAS# 142525-10-8]

Identification

• Name: (4S)-4-Amino-5-[[(2S)-6-Amino-1-[[(2S)-1-[[(2S,3S)-1-[[(2S)-1,3-Dihydroxy-1-Oxopropan-2-Yl]Amino]-3-Methyl-1-Oxopentan-2-Yl]Amino]-3-Methyl-1-Oxobutan-2-Yl]Amino]-1-Oxohexan-2-Yl]Amino]-5-Oxopentanoic Acid
• Synonyms: (4S)-4-Amino-5-[[(1S)-5-Amino-1-[[(1S)-1-[[(1S,2S)-1-[[(1S)-2-Hydroxy-1-(Hydroxymethyl)-2-Oxo-Ethyl]Carbamoyl]-2-Methyl-Butyl]Carbamoyl]-2-Methyl-Propyl]Carbamoyl]Pentyl]Amino]-5-Oxo-Pentanoic Acid; (4S)-4-Amino-5-[[(1S)-5-Amino-1-[[[(1S)-1-[[[(1S,2S)-1-[[[(1S)-2-Hydroxy-1-(Hydroxymethyl)-2-Oxoethyl]Amino]-Oxomethyl]-2-Methylbutyl]Amino]-Oxomethyl]-2-Methylpropyl]Amino]-Oxomethyl]Pentyl]Amino]-5-Oxopentanoic Acid; (4S)-4-Amino-5-[[(1S)-5-Amino-1-[[(1S)-1-[[(1S,2S)-1-[[(1S)-2-Hydroxy-2-Keto-1-Methylol-Ethyl]Carbamoyl]-2-Methyl-Butyl]Carbamoyl]-2-Methyl-Propyl]Carbamoyl]Pentyl]Amino]-5-Keto-Valeric Acid
• Molecular Formula: C₂₅H₄₆N₆O₉
• Molecular Weight: 574.67
• CAS Registry Number: 142525-10-8
• SMILES: [C@@H](N)(C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)[C@@H](C)CC)C(C)C)CCCCN)CCC(=O)O
• InChI: 1S/C25H46N6O9/c1-5-14(4)20(24(38)29-17(12-32)25(39)40)31-23(37)19(13(2)3)30-22(36)16(8-6-7-11-26)28-21(35)15(27)9-10-18(33)34/h13-17,19-20,32H,5-12,26-27H2,1-4H3,(H,28,35)(H,29,38)(H,30,36)(H,31,37)(H,33,34)(H,39,40)/t14-,15-,16-,17-,19-,20-/m0/s1
• InChIKey: FJJRCFWNKDENMI-BGZMIMFDSA-N

Properties

• Density: 1.245g/cm³ (Cal.)
• Boiling point: 989.469°C at 760 mmHg (Cal.)
• Flash point: 552.211°C (Cal.)