Alvimopan beta-D-Glucuronide
Product Code
TRC-A575790-10MG
Product Format
Neat
Molecular Formula
C31 H40 N2 O10
Molecular Weight
600.657
Product Categories
Product Information
Chemical Data
Analyte Name
Alvimopan beta-D-Glucuronide
Molecular Formula
C31 H40 N2 O10
Molecular Weight
600.657
Accurate Mass
600.268
SMILES
C[C@H]1CN(C[C@H](Cc2ccccc2)C(=O)NCC(=O)O)CC[C@@]1(C)c3cccc(O[C@@H]4O[C@@H]([C@@H](O)[C@H](O)[C@H]4O)C(=O)O)c3
InChI
InChI=1S/C31H40N2O10/c1-18-16-33(17-20(28(39)32-15-23(34)35)13-19-7-4-3-5-8-19)12-11-31(18,2)21-9-6-10-22(14-21)42-30-26(38)24(36)25(37)27(43-30)29(40)41/h3-10,14,18,20,24-27,30,36-38H,11-13,15-17H2,1-2H3,(H,32,39)(H,34,35)(H,40,41)/t18-,20-,24-,25-,26+,27-,30+,31+/m0/s1
IUPAC
(2S,3S,4S,5R,6S)-6-[3-[(3R,4R)-1-[(2S)-2-benzyl-3-(carboxymethylamino)-3-oxopropyl]-3,4-dimethylpiperidin-4-yl]phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
Product Data
Country of Origin
CANADA
Product Format
Neat