Leucyl-phenylalanyl-valyl-valyl-threonyl-leucyl-valyl-glycine
[CAS# 101848-26-4]

Identification

• Name: Leucyl-phenylalanyl-valyl-valyl-threonyl-leucyl-valyl-glycine
• Synonyms: 2-[[(2S)-2-[[(2S)-2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-Amino-4-Methyl-Pentanoyl]Amino]-3-Phenyl-Propanoyl]Amino]-3-Methyl-Butanoyl]Amino]-3-Methyl-Butanoyl]Amino]-3-Hydroxy-Butanoyl]Amino]-4-Methyl-Pentanoyl]Amino]-3-Methyl-Butanoyl]Amino]Acetic Acid; 2-[[(2S)-2-[[(2S)-2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-Amino-4-Methyl-1-Oxopentyl]Amino]-1-Oxo-3-Phenylpropyl]Amino]-3-Methyl-1-Oxobutyl]Amino]-3-Methyl-1-Oxobutyl]Amino]-3-Hydroxy-1-Oxobutyl]Amino]-4-Methyl-1-Oxopentyl]Amino]-3-Methyl-1-Oxobutyl]Amino]Acetic Acid; 2-[[(2S)-2-[[(2S)-2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-Amino-4-Methyl-Pentanoyl]Amino]-3-Phenyl-Propanoyl]Amino]-3-Methyl-Butanoyl]Amino]-3-Methyl-Butanoyl]Amino]-3-Hydroxy-Butanoyl]Amino]-4-Methyl-Pentanoyl]Amino]-3-Methyl-Butanoyl]Amino]Ethanoic Acid
• Molecular Formula: C₄₂H₇₀N₈O₁₀
• Molecular Weight: 847.06
• CAS Registry Number: 101848-26-4
• SMILES: [C@H](C(N[C@H](C(N[C@H](C(NCC(=O)O)=O)C(C)C)=O)CC(C)C)=O)(NC([C@@H](NC([C@@H](NC([C@@H](NC([C@H](CC(C)C)N)=O)CC1=CC=CC=C1)=O)C(C)C)=O)C(C)C)=O)[C@H](O)C
• InChI: 1S/C42H70N8O10/c1-21(2)17-28(43)36(54)45-30(19-27-15-13-12-14-16-27)38(56)48-33(24(7)8)40(58)49-34(25(9)10)41(59)50-35(26(11)51)42(60)46-29(18-22(3)4)37(55)47-32(23(5)6)39(57)44-20-31(52)53/h12-16,21-26,28-30,32-35,51H,17-20,43H2,1-11H3,(H,44,57)(H,45,54)(H,46,60)(H,47,55)(H,48,56)(H,49,58)(H,50,59)(H,52,53)/t26-,28+,29+,30+,32+,33+,34+,35+/m1/s1
• InChIKey: HHLGIVVEXQRCLK-GSNOCNGZSA-N

Properties

• Density: 1.167g/cm³ (Cal.)
• Boiling point: 1181.553°C at 760 mmHg (Cal.)
• Flash point: 668.379°C (Cal.)