Cyclo(glycyl-L-prolyl-L-phenylalanyl-L-prolylglycyl-L-prolyl-L-phenylalanyl-L-prolyl)
[CAS# 136314-94-8]

Identification

• Name: Cyclo(glycyl-L-prolyl-L-phenylalanyl-L-prolylglycyl-L-prolyl-L-phenylalanyl-L-prolyl)
• Synonyms: (2S)-1-[(2S)-2-[[(2S)-1-(2-Aminoacetyl)Pyrrolidine-2-Carbonyl]Amino]-3-Phenyl-Propanoyl]-N-[2-[(2S)-2-[[(1S)-2-[(2S)-2-Formylpyrrolidin-1-Yl]-2-Oxo-1-(Phenylmethyl)Ethyl]Carbamoyl]Pyrrolidin-1-Yl]-2-Oxo-Ethyl]-2,3-Dihydropyrrole-2-Carboxamide; (2S)-1-[(2S)-2-[[[(2S)-1-(2-Amino-1-Oxoethyl)-2-Pyrrolidinyl]-Oxomethyl]Amino]-1-Oxo-3-Phenylpropyl]-N-[2-[(2S)-2-[[[(1S)-2-[(2S)-2-Formyl-1-Pyrrolidinyl]-2-Oxo-1-(Phenylmethyl)Ethyl]Amino]-Oxomethyl]-1-Pyrrolidinyl]-2-Oxoethyl]-2,3-Dihydropyrrole-2-Carboxamide; (2S)-N-[2-[(2S)-2-[[(1S)-1-(Benzyl)-2-[(2S)-2-Formylpyrrolidin-1-Yl]-2-Keto-Ethyl]Carbamoyl]Pyrrolidin-1-Yl]-2-Keto-Ethyl]-1-[(2S)-2-[[(2S)-1-Glycylpyrrolidine-2-Carbonyl]Amino]-3-Phenyl-Propanoyl]-2-Pyrroline-2-Carboxamide
• Molecular Formula: C₄₂H₅₂N₈O₈
• Molecular Weight: 796.92
• CAS Registry Number: 136314-94-8
• SMILES: [C@@H]3(N(C(=O)[C@@H](NC(=O)[C@H]1N(C(=O)CN)CCC1)CC2=CC=CC=C2)C=CC3)C(=O)NCC(=O)N6[C@H](C(=O)N[C@H](C(=O)N4[C@@H](CCC4)C=O)CC5=CC=CC=C5)CCC6
• InChI: 1S/C42H52N8O8/c43-25-36(52)48-20-8-17-34(48)39(55)46-32(24-29-13-5-2-6-14-29)42(58)50-22-10-16-33(50)38(54)44-26-37(53)49-21-9-18-35(49)40(56)45-31(23-28-11-3-1-4-12-28)41(57)47-19-7-15-30(47)27-51/h1-6,10-14,22,27,30-35H,7-9,15-21,23-26,43H2,(H,44,54)(H,45,56)(H,46,55)/t30-,31-,32-,33-,34-,35-/m0/s1
• InChIKey: IKHNEMCWNPHENE-LBBUGJAGSA-N

Properties

• Density: 1.356g/cm³ (Cal.)
• Boiling point: 1195.642°C at 760 mmHg (Cal.)
• Flash point: 676.9°C (Cal.)