Products 1210608-88-0

CAS 1210608-88-0 is the registry number for Dabigatran-13C6. Offered by: Chemat Brand, TRC, MedChemExpress. Available pack sizes: on request, 10mg, 1mg, 5mg, 5 mg, 10 mg, 1 mg.

Dabigatran-13C6
Chemat Brand, TRC, MedChemExpress
  • size: on request, 10mg, 1mg, 5mg
  • Variants: 8
from 4211.36
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3-[[2-[[(4-carbamimidoyl(1,2,3,4,5,6-13C6)cyclohexa-1,3,5-trien-1-yl)amino]methyl]-1-methylbenzimidazole-5-carbonyl]-pyridin-2-ylamino]propanoic acid (CAS 1210608-88-0) is a chemical compound with the molecular formula C25H25N7O3 and a molecular weight of 477.5 g/mol. IUPAC name: 3-[[2-[[(4-carbamimidoyl(1,2,3,4,5,6-13C6)cyclohexa-1,3,5-trien-1-yl)amino]methyl]-1-methylbenzimidazole-5-carbonyl]-pyridin-2-ylamino]propanoic acid. InChIKey: YBSJFWOBGCMAKL-WLDHFFRPSA-N.

Identity
Molecular formulaC25H25N7O3
Molecular weight477.5 g/mol
IUPAC name3-[[2-[[(4-carbamimidoyl(1,2,3,4,5,6-13C6)cyclohexa-1,3,5-trien-1-yl)amino]methyl]-1-methylbenzimidazole-5-carbonyl]-pyridin-2-ylamino]propanoic acid
InChIKeyYBSJFWOBGCMAKL-WLDHFFRPSA-N
SMILESCN1C2=C(C=C(C=C2)C(=O)N(CCC(=O)O)C3=CC=CC=N3)N=C1CN[13C]4=[13CH][13CH]=[13C]([13CH]=[13CH]4)C(=N)N

Computed by PubChem (NCBI)

Synonyms: Dabigatran-13C6, Dabigatran 13C6, orb2300002
Related forms of this compound
3-[[2-[(4-carbamimidoylanilino)methyl]-1-methylbenzimidazole-5-carbonyl]-pyridin-2-ylamino]propanoic acid C25H25N7O3
3-[[2-[(4-carbamimidoylanilino)methyl]-1-(trideuteriomethyl)benzimidazole-5-carbonyl]-pyridin-2-ylamino]propanoic acid C25H25N7O3