1-Methylethyl-2-propyl-1H-imidazole-5-carboxylic Acid Ethyl Ester 2,3,4-Tri-O-acetyl-beta-D-glucuronide Methyl Ester
Product Code
TRC-M102830-50MG
Product Format
Neat
Molecular Formula
C25 H36 N2 O12
Molecular Weight
556.559
Product Categories
Product Information
Chemical Data
Analyte Name
1-Methylethyl-2-propyl-1H-imidazole-5-carboxylic Acid Ethyl Ester 2,3,4-Tri-O-acetyl-beta-D-glucuronide Methyl Ester
Molecular Formula
C25 H36 N2 O12
Molecular Weight
556.559
Accurate Mass
556.227
SMILES
CCCc1nc(c([nH]1)C(=O)OCC)C(C)(C)O[C@@H]2O[C@@H]([C@@H](OC(=O)C)[C@H](OC(=O)C)[C@H]2OC(=O)C)C(=O)OC
InChI
InChI=1S/C25H36N2O12/c1-9-11-15-26-16(22(31)34-10-2)21(27-15)25(6,7)39-24-20(37-14(5)30)18(36-13(4)29)17(35-12(3)28)19(38-24)23(32)33-8/h17-20,24H,9-11H2,1-8H3,(H,26,27)/t17-,18-,19-,20+,24-/m0/s1
IUPAC
ethyl 2-propyl-4-[2-[(2S,3R,4S,5S,6S)-3,4,5-triacetyloxy-6-methoxycarbonyloxan-2-yl]oxypropan-2-yl]-1H-imidazole-5-carboxylate
Product Data
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Format
Neat