threo-4-Hydroxy Ritalinic Acid Acyl-glucuronide
Product Code
TRC-H805210-50MG
Product Format
Neat
Molecular Formula
C19 H25 N O9
Molecular Weight
411.403
Product Categories
Product Information
Chemical Data
Analyte Name
threo-4-Hydroxy Ritalinic Acid Acyl-glucuronide
Molecular Formula
C19 H25 N O9
Molecular Weight
411.403
Accurate Mass
411.153
SMILES
O[C@@H]1[C@@H](O)[C@H](OC(=O)[C@H]([C@@H]2CCCCN2)c3ccc(O)cc3)O[C@@H]([C@H]1O)C(=O)O
InChI
InChI=1S/C19H25NO9/c21-10-6-4-9(5-7-10)12(11-3-1-2-8-20-11)18(27)29-19-15(24)13(22)14(23)16(28-19)17(25)26/h4-7,11-16,19-24H,1-3,8H2,(H,25,26)/t11-,12-,13-,14-,15+,16-,19-/m0/s1
IUPAC
(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[(2S)-2-(4-hydroxyphenyl)-2-[(2S)-piperidin-2-yl]acetyl]oxyoxane-2-carboxylic acid
Product Data
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Format
Neat