![beta-D-Glucopyranuronic acid, 1-[3-(4-hydroxyphenoxy)benzoate] structure](/static/products/668/66856-01-7.png)
beta-D-Glucopyranuronic acid, 1-[3-(4-hydroxyphenoxy)benzoate]
TL;DR: beta-D-Glucopyranuronic acid, 1-[3-(4-hydroxyphenoxy)benzoate] (CAS 66856-01-7) is a chemical compound with molecular formula C19H18O10 and molecular weight 406.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[3-(4-hydroxyphenoxy)benzoyl]oxyoxane-2-carboxylic acid
Also Known As: beta-D-Glucopyranuronic acid, 1-(3-(4-hydroxyphenoxy)benzoate), beta-D-Glucopyranuronic acid, 1-[3-(4-hydroxyphenoxy)benzoate], 1-O-[3-(4-Hydroxyphenoxy)benzoyl]-beta-D-glucopyranuronic acid, (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[3-(4-hydroxyphenoxy)benzoyl]oxyoxane-2-carboxylic acid, RefChem:119310
| Molecular Formula | C19H18O10 |
|---|---|
| Molecular Weight | 406.09 g/mol |
| LogP | 0.2335 |
| Topological Polar Surface Area | 162.98 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 406.09 |
| Heavy Atoms | 29 |
| Complexity | 880.81354 |
Chemical Identifiers
| CAS Number | 66856-01-7 |
|---|---|
| SMILES | C1=CC(=CC(=C1)OC2=CC=C(C=C2)O)C(=O)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)C(=O)O)O)O)O |
Product Overview
beta-D-Glucopyranuronic acid, 1-[3-(4-hydroxyphenoxy)benzoate] (CAS 66856-01-7), with molecular formula C19H18O10 and molecular weight 406.09 g/mol. IUPAC: (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[3-(4-hydroxyphenoxy)benzoyl]oxyoxane-2-carboxylic acid.
Chemical Property Profile of beta-D-Glucopyranuronic acid, 1-[3-(4-hydroxyphenoxy)benzoate]
Property Insights of beta-D-Glucopyranuronic acid, 1-[3-(4-hydroxyphenoxy)benzoate]
The XLogP value of 0.2335 suggests moderate lipophilicity, balancing water solubility and membrane permeability for beta-D-Glucopyranuronic acid, 1-[3-(4-hydroxyphenoxy)benzoate]. The TPSA of 162.98 Ų indicates high polarity, suggesting beta-D-Glucopyranuronic acid, 1-[3-(4-hydroxyphenoxy)benzoate] may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, beta-D-Glucopyranuronic acid, 1-[3-(4-hydroxyphenoxy)benzoate] has 5 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of beta-D-Glucopyranuronic acid, 1-[3-(4-hydroxyphenoxy)benzoate]?
The CAS number of beta-D-Glucopyranuronic acid, 1-[3-(4-hydroxyphenoxy)benzoate] is 66856-01-7.
What is the molecular formula of beta-D-Glucopyranuronic acid, 1-[3-(4-hydroxyphenoxy)benzoate]?
The molecular formula of beta-D-Glucopyranuronic acid, 1-[3-(4-hydroxyphenoxy)benzoate] is C19H18O10.
What is the molecular weight of beta-D-Glucopyranuronic acid, 1-[3-(4-hydroxyphenoxy)benzoate]?
The molecular weight of beta-D-Glucopyranuronic acid, 1-[3-(4-hydroxyphenoxy)benzoate] is 406.09 g/mol.
Where can I buy beta-D-Glucopyranuronic acid, 1-[3-(4-hydroxyphenoxy)benzoate]?
You can request a quote for beta-D-Glucopyranuronic acid, 1-[3-(4-hydroxyphenoxy)benzoate] directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for beta-D-Glucopyranuronic acid, 1-[3-(4-hydroxyphenoxy)benzoate]?
Yes, KEHONG BIO provides custom synthesis services for beta-D-Glucopyranuronic acid, 1-[3-(4-hydroxyphenoxy)benzoate] and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.