Cyclo(-Phe-Phe)
[CAS# 2862-51-3]

Identification

• Name: Cyclo(-Phe-Phe)
• Synonyms: (3S,6S)-3,6-Bis(Benzyl)Piperazine-2,5-Quinone; Cyclo(Phenylalanyl-Phenylalanyl); Zinc01389704
• Molecular Formula: C₁₈H₁₈N₂O₂
• Molecular Weight: 294.35
• CAS Registry Number: 2862-51-3
• SMILES: [C@H]1(NC([C@@H](NC1=O)CC2=CC=CC=C2)=O)CC3=CC=CC=C3
• InChI: 1S/C18H18N2O2/c21-17-15(11-13-7-3-1-4-8-13)19-18(22)16(20-17)12-14-9-5-2-6-10-14/h1-10,15-16H,11-12H2,(H,19,22)(H,20,21)/t15-,16-/m0/s1
• InChIKey: JUAPMRSLDANLAS-HOTGVXAUSA-N

Properties

• Density: 1.186g/cm³ (Cal.)
• Boiling point: 594.22°C at 760 mmHg (Cal.)
• Flash point: 229.831°C (Cal.)

References

• (1): Gondry et al.. Cyclodipeptide synthases are a family of tRNA-dependent peptide bond?forming enzymes, Nature Chemical Biology, 2009