Formyl-(Phenylalanyl)(6)-Phenylalanine Methyl Ester
[CAS# 91870-20-1]

Identification

• Name: Formyl-(Phenylalanyl)(6)-Phenylalanine Methyl Ester
• Synonyms: Hco-(Phe)7-Ome; L-Phenylalanine, N-(N-(N-(N-(N-(N-(N-Formyl-L-Phenylalanyl)-D-Phenylalanyl)-L-Phenylalanyl)-D-Phenylalanyl)-L-Phenylalanyl)-D-Phenylalanyl)-, (Z,E,E,E,E)-
• Molecular Formula: C₆₅H₆₇N₇O₉
• Molecular Weight: 1090.29
• CAS Registry Number: 91870-20-1
• SMILES: [C@H](C(OC)=O)(NC([C@H](NC([C@@H](NC([C@H](NC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@H](CC1=CC=CC=C1)NC=O)CC2=CC=CC=C2)CC3=CC=CC=C3)CC4=CC=CC=C4)=O)CC5=CC=CC=C5)=O)CC6=CC=CC=C6)=O)CC7=CC=CC=C7
• InChI: 1S/C65H67N7O9/c1-81-65(80)58(43-51-35-21-8-22-36-51)72-64(79)57(42-50-33-19-7-20-34-50)71-63(78)56(41-49-31-17-6-18-32-49)70-62(77)55(40-48-29-15-5-16-30-48)69-61(76)54(39-47-27-13-4-14-28-47)68-60(75)53(38-46-25-11-3-12-26-46)67-59(74)52(66-44-73)37-45-2
• InChIKey: PJAIVGAMYHHHSD-CNSVMYCBSA-N

Properties

• Density: 1.237g/cm³ (Cal.)
• Boiling point: 1358.1°C at 760 mmHg (Cal.)
• Flash point: 775.1°C (Cal.)