beta-D-Glucopyranosiduronic acid, 4-amino-2-methoxyphenyl
TL;DR: beta-D-Glucopyranosiduronic acid, 4-amino-2-methoxyphenyl (CAS 96107-44-7) is a chemical compound with molecular formula C13H17NO8 and molecular weight 315.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3S,4S,5R,6S)-6-(4-amino-2-methoxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid
Also Known As: beta-D-Glucopyranosiduronic acid, 4-amino-2-methoxyphenyl, 4-Amino-2-methoxyphenyl beta-D-glucopyranosiduronic acid, (2S,3S,4S,5R,6S)-6-(4-amino-2-methoxy-phenoxy)-3,4,5-trihydroxy-oxane-2-carboxylic Acid, (2S,3S,4S,5R,6S)-6-(4-amino-2-methoxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid
| Molecular Formula | C13H17NO8 |
|---|---|
| Molecular Weight | 315.10 g/mol |
| LogP | -0.7 |
| Topological Polar Surface Area | 152.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 4 |
| Exact Mass | 315.09543 |
| Heavy Atoms | 22 |
| Complexity | 394.0 |
Chemical Identifiers
| CAS Number | 96107-44-7 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)N)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C(=O)O)O)O)O |
| InChIKey | AEQLXENHGOOUBS-XPORZQOISA-N |
Product Overview
beta-D-Glucopyranosiduronic acid, 4-amino-2-methoxyphenyl (CAS 96107-44-7), with molecular formula C13H17NO8 and molecular weight 315.10 g/mol. IUPAC: (2S,3S,4S,5R,6S)-6-(4-amino-2-methoxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid.
Chemical Property Profile of beta-D-Glucopyranosiduronic acid, 4-amino-2-methoxyphenyl
Property Insights of beta-D-Glucopyranosiduronic acid, 4-amino-2-methoxyphenyl
The XLogP value of -0.7 indicates that beta-D-Glucopyranosiduronic acid, 4-amino-2-methoxyphenyl is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 152.0 Ų indicates high polarity, suggesting beta-D-Glucopyranosiduronic acid, 4-amino-2-methoxyphenyl may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, beta-D-Glucopyranosiduronic acid, 4-amino-2-methoxyphenyl 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-Glucopyranosiduronic acid, 4-amino-2-methoxyphenyl?
The CAS number of beta-D-Glucopyranosiduronic acid, 4-amino-2-methoxyphenyl is 96107-44-7.
What is the molecular formula of beta-D-Glucopyranosiduronic acid, 4-amino-2-methoxyphenyl?
The molecular formula of beta-D-Glucopyranosiduronic acid, 4-amino-2-methoxyphenyl is C13H17NO8.
What is the molecular weight of beta-D-Glucopyranosiduronic acid, 4-amino-2-methoxyphenyl?
The molecular weight of beta-D-Glucopyranosiduronic acid, 4-amino-2-methoxyphenyl is 315.10 g/mol.
Where can I buy beta-D-Glucopyranosiduronic acid, 4-amino-2-methoxyphenyl?
You can request a quote for beta-D-Glucopyranosiduronic acid, 4-amino-2-methoxyphenyl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for beta-D-Glucopyranosiduronic acid, 4-amino-2-methoxyphenyl?
Yes, KEHONG BIO provides custom synthesis services for beta-D-Glucopyranosiduronic acid, 4-amino-2-methoxyphenyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.