D-Phenylalanyl-L-Phenylalanyl-L-Phenylalanyl-D-Tryptophyl-L-Lysyl-L-Threonyl-L-Phenylalanyl-L-Threoninamide
[CAS# 133073-82-2]

Identification

• Name: D-Phenylalanyl-L-Phenylalanyl-L-Phenylalanyl-D-Tryptophyl-L-Lysyl-L-Threonyl-L-Phenylalanyl-L-Threoninamide
• Synonyms: BIM 23052
• Molecular Formula: C₆₁H₇₄N₁₁O₁₀
• Molecular Weight: 1122.32
• CAS Registry Number: 133073-82-2
• SMILES: C[C@H]([C@@H](C(=O)N)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](CC2=CNC3=CC=CC=C32)NC(=O)[C@H](CC4=CC=CC=C4)NC(=O)[C@H](CC5=CC=CC=C5)NC(=O)[C@@H](CC6=CC=CC=C6)N)O
• InChI: 1S/C61H75N11O10/c1-37(73)52(54(64)75)71-60(81)50(34-42-25-13-6-14-26-42)70-61(82)53(38(2)74)72-56(77)47(29-17-18-30-62)66-59(80)51(35-43-36-65-46-28-16-15-27-44(43)46)69-58(79)49(33-41-23-11-5-12-24-41)68-57(78)48(32-40-21-9-4-10-22-40)67-55(76)45(63)31-39-19-7-3-8-20-39/h3-16,19-28,36-38,45,47-53,65,73-74H,17-18,29-35,62-63H2,1-2H3,(H2,64,75)(H,66,80)(H,67,76)(H,68,78)(H,69,79)(H,70,82)(H,71,81)(H,72,77)/t37-,38-,45-,47+,48+,49+,50+,51-,52+,53+/m1/s1
• InChIKey: HMTCBXPQKWFOMG-QWXJMLLVSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Boiling point: 1506.0±65.0°C at 760 mmHg (Cal.)
• Flash point: 864.6±34.3°C (Cal.)
• Refractive index: 1.629 (Cal.)
• solubility: Soluble to 2 mg/ml in 20% acetonitrile