6-gingerol-4'-O-beta-glucuronate
TL;DR: 6-gingerol-4'-O-beta-glucuronate (CAS 463953-76-6) is a chemical compound with molecular formula C23H34O10 and molecular weight 470.22 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-[4-[(5S)-5-hydroxy-3-oxodecyl]-2-methoxyphenoxy]oxane-2-carboxylic acid
Also Known As: 6-gingerol-4'-O-beta-glucuronate, (S)-6-Gingerol-4'-O-beta-glucuronide
| Molecular Formula | C23H34O10 |
|---|---|
| Molecular Weight | 470.22 g/mol |
| LogP | 0.7992 |
| Topological Polar Surface Area | 162.98 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 13 |
| Exact Mass | 470.2152 |
| Heavy Atoms | 33 |
| Complexity | 782.5057 |
Chemical Identifiers
| CAS Number | 463953-76-6 |
|---|---|
| SMILES | CCCCC[C@@H](CC(=O)CCC1=CC(=C(C=C1)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C(=O)O)O)O)O)OC)O |
Product Overview
6-gingerol-4'-O-beta-glucuronate (CAS 463953-76-6), with molecular formula C23H34O10 and molecular weight 470.22 g/mol. IUPAC: (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[4-[(5S)-5-hydroxy-3-oxodecyl]-2-methoxyphenoxy]oxane-2-carboxylic acid.
Chemical Property Profile of 6-gingerol-4'-O-beta-glucuronate
Property Insights of 6-gingerol-4'-O-beta-glucuronate
The XLogP value of 0.7992 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-gingerol-4'-O-beta-glucuronate. The TPSA of 162.98 Ų indicates high polarity, suggesting 6-gingerol-4'-O-beta-glucuronate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 6-gingerol-4'-O-beta-glucuronate 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 6-gingerol-4'-O-beta-glucuronate?
The CAS number of 6-gingerol-4'-O-beta-glucuronate is 463953-76-6.
What is the molecular formula of 6-gingerol-4'-O-beta-glucuronate?
The molecular formula of 6-gingerol-4'-O-beta-glucuronate is C23H34O10.
What is the molecular weight of 6-gingerol-4'-O-beta-glucuronate?
The molecular weight of 6-gingerol-4'-O-beta-glucuronate is 470.22 g/mol.
Where can I buy 6-gingerol-4'-O-beta-glucuronate?
You can request a quote for 6-gingerol-4'-O-beta-glucuronate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-gingerol-4'-O-beta-glucuronate?
Yes, KEHONG BIO provides custom synthesis services for 6-gingerol-4'-O-beta-glucuronate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.