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Desethyl Dabigatran Etexilate, TRC

Product Code. 30352702
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50 mg
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Product Code. 30352702 Supplier Toronto Research Chemicals Supplier No. TRCD28907050MG

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Specifications

Chemical Name or Material Desethyldabigatran Etexilate
CAS 212321-78-3
Purity Grade Notes HPLC
Molecular Formula C32 H37 N7 O5
Quantity 50 mg
Synonym Desethyl Dabigatran Etexilate, BIBR 1087 SE, N-[[2-[[[4-[[[(Hexyloxy)carbonyl]amino]iminomethyl]phenyl]amino]methyl]-1-methyl-1H-benzimidazol-5-yl]carbonyl]-N-2-pyridinyl-β-alanine
InChI Formula InChI=1S/C32H37N7O5/c1-3-4-5-8-19-44-32(43)37-30(33)22-10-13-24(14-11-22)35-21-28-36-25-20-23(12-15-26(25)38(28)2)31(42)39(18-16-29(40)41)27-9-6-7-17-34-27/h6-7,9-15,17,20,35H,3-5,8,16,18-19,21H2,1-2H3,(H,40,41)(H2,33,37,43)
SMILES CCCCCCOC(=O)NC(=N)c1ccc(NCc2nc3cc(ccc3n2C)C(=O)N(CCC(=O)O)c4ccccn4)cc1
IUPAC Name 3-[[2-[[4-(N-hexoxycarbonylcarbamimidoyl)anilino]methyl]-1-methylbenzimidazole-5-carbonyl]-pyridin-2-ylamino]propanoic acid
Molecular Weight (g/mol) 599.68
Formula Weight 599.2856
Percent Purity >95
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