Cyclic(3-1)-1-(carboxymethyl)prolyl-phenylalanyl-histidinamide
[CAS# 132235-85-9]

Identification

• Name: Cyclic(3-1)-1-(carboxymethyl)prolyl-phenylalanyl-histidinamide
• Synonyms: Cyclic(3-1)-1-(Carboxymethyl)Prolyl-Phenylalanyl-Histidinamide; Cyclo(Cm-Pro-Phe-His-Nh2); 11,8-Metheno-1H-Pyrrolo(1,2-F)(1,3,6,9,12)Pentaazacyclopentadecine-6-Carboxylic Acid, 2,3,4,5,6,7,12,13,15,16,17,17A-Dodecahydro-1,4,13-Trioxo-3-(Phenylmethyl)-, (3S-(3R*,6R*,17Ar*))-
• Molecular Formula: C₂₂H₂₅N₅O₅
• Molecular Weight: 439.47
• CAS Registry Number: 132235-85-9
• SMILES: [N]12CC(=O)N4[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(=C1)N=C2)C(=O)O)CC3=CC=CC=C3)CCC4
• InChI: 1S/C22H25N5O5/c28-19-12-26-11-15(23-13-26)10-17(22(31)32)25-20(29)16(9-14-5-2-1-3-6-14)24-21(30)18-7-4-8-27(18)19/h1-3,5-6,11,13,16-18H,4,7-10,12H2,(H,24,30)(H,25,29)(H,31,32)/t16-,17-,18-/m0/s1
• InChIKey: BRDOIPUWLRDLHZ-BZSNNMDCSA-N

Properties

• Density: 1.492g/cm³ (Cal.)
• Boiling point: 919.765°C at 760 mmHg (Cal.)
• Flash point: 510.056°C (Cal.)