Glycyl-D-alpha-Aspartylglycyl-D-Arginyl-D-Leucyl-D-Tyrosyl-L-Alanyl-D-Phenylalanylglycyl-L-Leucinamide
[CAS# 123338-11-4]

Identification

• Name: Glycyl-D-alpha-Aspartylglycyl-D-Arginyl-D-Leucyl-D-Tyrosyl-L-Alanyl-D-Phenylalanylglycyl-L-Leucinamide
• Synonyms: Allatostatin II; Glycyl-D-α-aspartylglycyl-D-arginyl-D-leucyl-D-tyrosyl-L-alanyl-D-phenylalanylglycyl-L-leucinamide; L-Leucinamide, glycyl-D-α-aspartylglycyl-D-arginyl-D-leucyl-D-tyrosyl-L-alanyl-D-phenylalanylglycyl-
• Molecular Formula: C₄₉H₇₄N₁₄O₁₃
• Molecular Weight: 1067.20
• CAS Registry Number: 123338-11-4
• SMILES: C[C@@H](C(=O)N[C@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N)NC(=O)[C@@H](Cc2ccc(cc2)O)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H](CC(=O)O)NC(=O)CN
• InChI: 1S/C49H74N14O13/c1-26(2)18-33(42(51)70)59-40(67)25-55-44(72)35(20-29-10-7-6-8-11-29)61-43(71)28(5)57-47(75)36(21-30-13-15-31(64)16-14-30)63-48(76)34(19-27(3)4)62-46(74)32(12-9-17-54-49(52)53)58-39(66)24-56-45(73)37(22-41(68)69)60-38(65)23-50/h6-8,10-11,13-16,26-28,32-37,64H,9,12,17-25,50H2,1-5H3,(H2,51,70)(H,55,72)(H,56,73)(H,57,75)(H,58,66)(H,59,67)(H,60,65)(H,61,71)(H,62,74)(H,63,76)(H,68,69)(H4,52,53,54)/t28-,32+,33-,34+,35+,36+,37+/m0/s1
• InChIKey: WGQGYYOXEWOITJ-FNZUBJHWSA-N

Properties

• Density: 1.4±0.1g/cm³ (Cal.)
• Refractive index: 1.639 (Cal.)