Linagliptin-13C-d3
Product Code
TRC-L465903-50MG
CAS Number
Product Format
Neat
Molecular Formula
13C C24 D3 H25 N8 O2
Molecular Weight
476.553
Product Categories
Product Type
Stable Isotope LabelledProduct Information
Chemical Data
Analyte Name
Linagliptin-13C,D3 (2-butyn-1-yl-4-13C,4,4,4-D3)
CAS Number
1398044-43-3
Molecular Formula
13C C24 D3 H25 N8 O2
Molecular Weight
476.553
Accurate Mass
476.256
SMILES
[2H][13C]([2H])([2H])C#CCn1c(nc2N(C)C(=O)N(Cc3nc(C)c4ccccc4n3)C(=O)c12)N5CCC[C@@H](N)C5
InChI
InChI=1S/C25H28N8O2/c1-4-5-13-32-21-22(29-24(32)31-12-8-9-17(26)14-31)30(3)25(35)33(23(21)34)15-20-27-16(2)18-10-6-7-11-19(18)28-20/h6-7,10-11,17H,8-9,12-15,26H2,1-3H3/t17-/m1/s1/i1+1D3
IUPAC
8-[(3R)-3-aminopiperidin-1-yl]-3-methyl-1-[(4-methylquinazolin-2-yl)methyl]-7-(4,4,4-trideuterio(4^{13}C)but-2-ynyl)purine-2,6-dione
SIL Type
Carbon, Deuterium
Product Data
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Format
Neat
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