CAS 137908-78-2

Ethanaminium, 2-(diphenylmethoxy)-N-β-D-glucopyranuronosyl-N,N-dimethyl-, inner salt

Description:

Ethanaminium, 2-(diphenylmethoxy)-N-β-D-glucopyranuronosyl-N,N-dimethyl-, inner salt, identified by CAS number 137908-78-2, is a complex organic compound characterized by its quaternary ammonium structure. This substance features a glucopyranuronosyl moiety, which contributes to its potential biological activity, particularly in interactions with biological membranes or as a surfactant. The presence of diphenylmethoxy groups suggests that it may exhibit hydrophobic properties, enhancing its solubility in organic solvents while potentially limiting its solubility in water. The dimethylamino groups indicate that it can participate in various chemical reactions, including quaternization and nucleophilic substitutions. As an inner salt, it possesses both cationic and anionic characteristics, which may influence its stability and reactivity in different environments. Overall, this compound may have applications in pharmaceuticals, biochemistry, or materials science, although specific uses would depend on further research into its properties and interactions.

Formula: C₂₃H₂₉NO₇

InChI: InChI=1/C23H29NO7/c1-24(2,22-19(27)17(25)18(26)21(31-22)23(28)29)13-14-30-20(15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-12,17-22,25-27H,13-14H2,1-2H3/t17-,18-,19+,21-,22+/m0/s1

InChI key: InChIKey=OAIGZXXQYIJBLR-WJJPVSRMSA-N

SMILES: [N@+](CCOC(C1=CC=CC=C1)C2=CC=CC=C2)(C)(C)[C@@H]3O[C@H](C([O-])=O)[C@@H](O)[C@H](O)[C@H]3O

Synonyms:

• Ethanaminium, 2-(diphenylmethoxy)-N-β-D-glucopyranuronosyl-N,N-dimethyl-, inner salt
• Diphenhydramine N-glucuronide
• DiphenhydraMine N-β-D-Glucuronide
• Diphenhydramine N-GlucuronideQ: What is
• Diphenhydramine N-Glucuronide Q: What is the CAS Number of

Diphenhydramine N-b-D-Glucuronide

CAS: 137908-78-2

Formula: C₂₃H₂₉NO₇

Color and Shape: Solid

Molecular weight: 431.4789

Ref: IN-DA001437

Diphenhydramine N-Glucuronide

CAS: 137908-78-2

Formula: C₂₃H₂₉NO₇

Color and Shape: Yellow Solid

Molecular weight: 431.49

Ref: 4Z-D-084

Diphenhydramine N-β-D-Glucuronide

CAS: 137908-78-2

Applications A glucuronide metabolite of Diphenhydramine (D486900) in humans.
References Breyer-Pfaff, U., et al.: Drug Metab. Dispos., 25, 340 (1997),

Formula: C₂₃H₂₉NO₇

Color and Shape: Neat

Molecular weight: 431.48

Ref: TR-D486910

Diphenhydramine-d6 N-β-D-Glucuronide

Controlled Product

CAS: 137908-78-2

Applications A labelled glucuronide metabolite of Diphenhydramine (D486900) in humans.
References Breyer-Pfaff, U., et al.: Drug Metab. Dispos., 25, 340 (1997),

Formula: C₂₃H₂₃D₆NO₇

Color and Shape: Neat

Molecular weight: 437.52

Ref: TR-D486912

Diphenhydramine N-Glucuronide

CAS: 137908-78-2

Formula: C₂₃H₂₉NO₇

Molecular weight: 431.49

Ref: ST-EA-CP-D413001