Sitagliptin Carbamoyl beta-D-Glucuronide Methyl Ester
Product Code
TRC-S491010-5MG
Product Format
Neat
Molecular Formula
C24 H25 F6 N5 O9
Molecular Weight
641.474
Product Categories
Price and availability
Product Information
Product Data
Analyte Name
Sitagliptin Carbamoyl beta-D-Glucuronide Methyl Ester
Molecular Formula
C24 H25 F6 N5 O9
Molecular Weight
641.474
Accurate Mass
641.156
SMILES
COC(=O)[C@H]1O[C@@H](OC(=O)N[C@@H](CC(=O)N2CCn3c(C2)nnc3C(F)(F)F)Cc4cc(F)c(F)cc4F)[C@H](O)[C@@H](O)[C@@H]1O
InChI
InChI=1S/C24H25F6N5O9/c1-42-20(40)19-17(38)16(37)18(39)21(43-19)44-23(41)31-10(4-9-5-12(26)13(27)7-11(9)25)6-15(36)34-2-3-35-14(8-34)32-33-22(35)24(28,29)30/h5,7,10,16-19,21,37-39H,2-4,6,8H2,1H3,(H,31,41)/t10-,16+,17+,18-,19+,21+/m1/s1
IUPAC
methyl (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[[(2R)-4-oxo-4-[3-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl]-1-(2,4,5-trifluorophenyl)butan-2-yl]carbamoyloxy]oxane-2-carboxylate
Storage & Transport Information
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Attributes
Product Format
Neat
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