L-Phenylalanyl-L-leucylglycyl-L-phenylalanyl-L-prolyl-L-Threonine
[CAS# 137833-32-0]

Identification

• Name: L-Phenylalanyl-L-leucylglycyl-L-phenylalanyl-L-prolyl-L-Threonine
• Synonyms: (2S,3R)-2-[[(2S)-1-[(2S)-2-[[2-[[(2S)-2-[[(2R)-2-Amino-3-Phenyl-Propanoyl]Amino]-4-Methyl-Pentanoyl]Amino]Acetyl]Amino]-3-Phenyl-Propanoyl]Pyrrolidine-2-Carbonyl]Amino]-3-Hydroxy-Butanoic Acid; (2S,3R)-2-[[[(2S)-1-[(2S)-2-[[2-[[(2S)-2-[[(2R)-2-Amino-1-Oxo-3-Phenylpropyl]Amino]-4-Methyl-1-Oxopentyl]Amino]-1-Oxoethyl]Amino]-1-Oxo-3-Phenylpropyl]-2-Pyrrolidinyl]-Oxomethyl]Amino]-3-Hydroxybutanoic Acid; (2S,3R)-2-[[(2S)-1-[(2S)-2-[[2-[[(2S)-2-[[(2R)-2-Amino-3-Phenyl-Propanoyl]Amino]-4-Methyl-Pentanoyl]Amino]Acetyl]Amino]-3-Phenyl-Propanoyl]Pyrrolidine-2-Carbonyl]Amino]-3-Hydroxy-Butyric Acid
• Molecular Formula: C₃₅H₄₈N₆O₈
• Molecular Weight: 680.80
• CAS Registry Number: 137833-32-0
• SMILES: [C@@H](NC([C@H]3N(C([C@@H](NC(=O)CNC([C@@H](NC([C@@H](CC1=CC=CC=C1)N)=O)CC(C)C)=O)CC2=CC=CC=C2)=O)CCC3)=O)(C(=O)O)[C@H](O)C
• InChI: 1S/C35H48N6O8/c1-21(2)17-26(39-31(44)25(36)18-23-11-6-4-7-12-23)32(45)37-20-29(43)38-27(19-24-13-8-5-9-14-24)34(47)41-16-10-15-28(41)33(46)40-30(22(3)42)35(48)49/h4-9,11-14,21-22,25-28,30,42H,10,15-20,36H2,1-3H3,(H,37,45)(H,38,43)(H,39,44)(H,40,46)(H,48,49)/t22-,25-,26+,27+,28+,30+/m1/s1
• InChIKey: GJQDTIRGBUXHLF-PKNHJBQWSA-N

Properties

• Density: 1.27g/cm³ (Cal.)
• Boiling point: 1074.287°C at 760 mmHg (Cal.)
• Flash point: 603.507°C (Cal.)