Phenylalanyl-glycyl-leucyl-glutaminyl-leucyl-glutamyl-leucyl-threonine
[CAS# 135467-95-7]

Identification

• Name: Phenylalanyl-glycyl-leucyl-glutaminyl-leucyl-glutamyl-leucyl-threonine
• Synonyms: (4S)-4-[[(2S)-2-[[(2S)-5-Amino-2-[[(2S)-2-[[2-[[(2S)-2-Amino-3-Phenyl-Propanoyl]Amino]Acetyl]Amino]-4-Methyl-Pentanoyl]Amino]-5-Oxo-Pentanoyl]Amino]-4-Methyl-Pentanoyl]Amino]-5-[[(1S)-1-[[(1S,2R)-1-Carboxy-2-Hydroxy-Propyl]Carbamoyl]-3-Methyl-Butyl]Amino]-5-Oxo-Pentanoic Acid; (4S)-4-[[(2S)-2-[[(2S)-5-Amino-2-[[(2S)-2-[[2-[[(2S)-2-Amino-1-Oxo-3-Phenylpropyl]Amino]-1-Oxoethyl]Amino]-4-Methyl-1-Oxopentyl]Amino]-1,5-Dioxopentyl]Amino]-4-Methyl-1-Oxopentyl]Amino]-5-[[(1S)-1-[[[(1S,2R)-1-Carboxy-2-Hydroxypropyl]Amino]-Oxomethyl]-3-Methylbutyl]Amino]-5-Oxopentanoic Acid; (4S)-4-[[(2S)-2-[[(2S)-5-Amino-2-[[(2S)-2-[[2-[[(2S)-2-Amino-3-Phenyl-Propanoyl]Amino]Acetyl]Amino]-4-Methyl-Pentanoyl]Amino]-5-Keto-Pentanoyl]Amino]-4-Methyl-Pentanoyl]Amino]-5-[[(1S)-1-[[(1S,2R)-1-Carboxy-2-Hydroxy-Propyl]Carbamoyl]-3-Methyl-Butyl]Amino]-5-Keto-Valeric Acid
• Molecular Formula: C₄₃H₆₉N₉O₁₃
• Molecular Weight: 920.07
• CAS Registry Number: 135467-95-7
• SMILES: [C@H](C(=O)O)(NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC(CNC([C@@H](N)CC1=CC=CC=C1)=O)=O)CC(C)C)=O)CCC(=O)N)=O)CC(C)C)=O)CCC(=O)O)=O)CC(C)C)=O)[C@@H](C)O
• InChI: 1S/C43H69N9O13/c1-22(2)17-30(47-34(55)21-46-37(58)27(44)20-26-11-9-8-10-12-26)40(61)48-28(13-15-33(45)54)38(59)50-31(18-23(3)4)41(62)49-29(14-16-35(56)57)39(60)51-32(19-24(5)6)42(63)52-36(25(7)53)43(64)65/h8-12,22-25,27-32,36,53H,13-21,44H2,1-7H3,(H2,45,54)(H,46,58)(H,47,55)(H,48,61)(H,49,62)(H,50,59)(H,51,60)(H,52,63)(H,56,57)(H,64,65)/t25-,27+,28+,29+,30+,31+,32+,36+/m1/s1
• InChIKey: IKOYOTRBIJAJQX-ZPXWBUFFSA-N

Properties

• Density: 1.249g/cm³ (Cal.)
• Boiling point: 1347.746°C at 760 mmHg (Cal.)
• Flash point: 768.889°C (Cal.)