Cyclo(RGDyK) Trifluoroacetate
[CAS# 250612-42-1]

Identification

• Name: Cyclo(RGDyK) Trifluoroacetate
• Synonyms: Cyclo (RGDyK); Cyclo RGDyK; Cyclo(RGDyK) trifluoroacetate
• Molecular Formula: C₃₁H₄₃F₆N₉O₁₂
• Molecular Weight: 847.71
• CAS Registry Number: 250612-42-1
• SMILES: C1C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)N1)CCCN=C(N)N)CCCCN)CC2=CC=C(C=C2)O)CC(=O)O.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O
• InChI: 1S/C27H41N9O8.2C2HF3O2/c28-10-2-1-4-18-24(42)34-17(5-3-11-31-27(29)30)23(41)32-14-21(38)33-20(13-22(39)40)26(44)36-19(25(43)35-18)12-15-6-8-16(37)9-7-15;2*3-2(4,5)1(6)7/h6-9,17-20,37H,1-5,10-14,28H2,(H,32,41)(H,33,38)(H,34,42)(H,35,43)(H,36,44)(H,39,40)(H4,29,30,31);2*(H,6,7)/t17-,18-,19+,20-;;/m0../s1
• InChIKey: CDDUWKKOPQABPG-TVSMIREGSA-N

Properties

• solubility: Soluble in DMSO (100mg/mL), Water (100mg/mL), Ethanol (20mg/mL)