Products 2253167-09-6

CAS 2253167-09-6 is the registry number for MM-589 (TFA), 98.67%. Offered by: MedChemExpress, Chemat. Available pack sizes: 1 mg, 1mg.

Structural formula: {0} (CAS {1})

N-[(3R,6S,9S,12R)-6-ethyl-12-methyl-9-[3-[(N'-methylcarbamimidoyl)amino]propyl]-2,5,8,11-tetraoxo-3-phenyl-1,4,7,10-tetrazacyclotetradec-12-yl]-2-methylpropanamide;2,2,2-trifluoroacetic acid (CAS 2253167-09-6) is a chemical compound with the molecular formula C30H45F3N8O7 and a molecular weight of 686.7 g/mol. IUPAC name: N-[(3R,6S,9S,12R)-6-ethyl-12-methyl-9-[3-[(N'-methylcarbamimidoyl)amino]propyl]-2,5,8,11-tetraoxo-3-phenyl-1,4,7,10-tetrazacyclotetradec-12-yl]-2-methylpropanamide;2,2,2-trifluoroacetic acid. InChIKey: NARXNZHWAWPJIY-HTCBAMNXSA-N.

Identity
Molecular formulaC30H45F3N8O7
Molecular weight686.7 g/mol
IUPAC nameN-[(3R,6S,9S,12R)-6-ethyl-12-methyl-9-[3-[(N'-methylcarbamimidoyl)amino]propyl]-2,5,8,11-tetraoxo-3-phenyl-1,4,7,10-tetrazacyclotetradec-12-yl]-2-methylpropanamide;2,2,2-trifluoroacetic acid
InChIKeyNARXNZHWAWPJIY-HTCBAMNXSA-N
SMILESCC[C@H]1C(=O)N[C@@H](C(=O)NCC[C@@](C(=O)N[C@H](C(=O)N1)CCCNC(=NC)N)(C)NC(=O)C(C)C)C2=CC=CC=C2.C(=O)(C(F)(F)F)O

Computed by PubChem (NCBI)

Synonyms: orb1709099