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Catalog Number | CI-BP-0094 |
Product Name | Cyclopeptide-5 |
CAS | 197172-76-2 |
Synonyms | Cyclo(1-aminocyclohexanecarbonyl-L-arginylglycyl-L-alpha-aspartyl-D-phenylalanyl) |
IUPAC Name | 2-[(9R,12S,18S)-9-benzyl-18-[3-(diaminomethylideneamino)propyl]-8,11,14,17,20-pentaoxo-7,10,13,16,19-pentazaspiro[5.14]icosan-12-yl]acetic acid |
Molecular Weight | 600.67 g/mol |
Molecular Formula | C28H40N8O7 |
InChI | InChI=1S/C28H40N8O7/c29-27(30)31-13-7-10-18-23(40)32-16-21(37)33-20(15-22(38)39)24(41)34-19(14-17-8-3-1-4-9-17)25(42)36-28(26(43)35-18)11-5-2-6-12-28/h1,3-4,8-9,18-20H,2,5-7,10-16H2,(H,32,40)(H,33,37)(H,34,41)(H,35,43)(H,36,42)(H,38,39)(H4,29,30,31)/t18-,19+,20-/m0/s1 |
InChI Key | ROFCWWUBJHHVGZ-ZCNNSNEGSA-N |
Density | 1.48 g/mL |
Isomeric SMILES | C1CCC2(CC1)C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](C(=O)N2)CC3=CC=CC=C3)CC(=O)O)CCCN=C(N)N |
pKa | 4.00±0.10 |
Safety | No heavy metals, no skin and eye irritation |