O-Octyl-d3 Dabigatran Ethyl Ester
Product Code
TRC-O239992-50MG
Product Format
Neat
Molecular Formula
C36 D3 H42 N7 O5
Molecular Weight
658.805
Product Categories
Product Type
Stable Isotope LabelledPrice and availability
Product Information
Product Data
Analyte Name
O-Octyl-d3 Dabigatran Ethyl Ester
Molecular Formula
C36 D3 H42 N7 O5
Molecular Weight
658.805
Accurate Mass
658.367
SMILES
[2H]C([2H])([2H])n1c(CNc2ccc(cc2)C(=N)NC(=O)OCCCCCCCC)nc3cc(ccc13)C(=O)N(CCC(=O)OCC)c4ccccn4
InChI
InChI=1S/C36H45N7O5/c1-4-6-7-8-9-12-23-48-36(46)41-34(37)26-14-17-28(18-15-26)39-25-32-40-29-24-27(16-19-30(29)42(32)3)35(45)43(22-20-33(44)47-5-2)31-13-10-11-21-38-31/h10-11,13-19,21,24,39H,4-9,12,20,22-23,25H2,1-3H3,(H2,37,41,46)/i3D3
IUPAC
ethyl 3-[[2-[[4-(N-octoxycarbonylcarbamimidoyl)anilino]methyl]-1-(trideuteriomethyl)benzimidazole-5-carbonyl]-pyridin-2-ylamino]propanoate
SIL Type
Deuterium
Storage & Transport Information
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Attributes
Product Format
Neat
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