21085-72-3 | Acetobromo-alpha-D-glucuronic acid methyl ester

Packsize	Purity	Availability	Price	Discounted Price
5g	≥98%	in stock	$16.00	$11.00
10g	≥98%	in stock	$30.00	$21.00
25g	≥98%	in stock	$73.00	$51.00
100g	≥98%	in stock	$289.00	$202.00

Description

• Catalog Number: AB50351
• Chemical Name: Acetobromo-alpha-D-glucuronic acid methyl ester
• CAS Number: 21085-72-3
• Molecular Formula: C13H17BrO9
• Molecular Weight: 397.1727
• MDL Number: MFCD00061613
• SMILES: COC(=O)[C@H]1O[C@H](Br)[C@@H]([C@H]([C@@H]1OC(=O)C)OC(=O)C)OC(=O)C

Computed Properties

• Complexity: 492
• Covalently-Bonded Unit Count: 1
• Defined Atom Stereocenter Count: 5
• Heavy Atom Count: 23
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 8
• XLogP3: 0.6

Literature

• An improved chemo-enzymatic synthesis of 1-beta-O-acyl glucuronides: highly chemoselective enzymatic removal of protecting groups from corresponding methyl acetyl derivatives.

  The Journal of organic chemistry 20071207

• Synthesis of 1-beta-O-acyl glucuronides of diclofenac, mefenamic acid and (S)-naproxen by the chemo-selective enzymatic removal of protecting groups from the corresponding methyl acetyl derivatives.

  Organic & biomolecular chemistry 20060907

• Preparation of pyridine-N-glucuronides of tobacco-specific nitrosamines.

  Chemical research in toxicology 20010501