6-O-malonyl-beta-methyl-D-glucopyranoside
TL;DR: 6-O-malonyl-beta-methyl-D-glucopyranoside (CAS 79384-28-4) is a chemical compound with molecular formula C10H16O9 and molecular weight 280.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-oxo-3-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-methoxyoxan-2-yl]methoxy]propanoic acid
Also Known As: 6-O-malonyl-beta-methyl-D-glucopyranoside, 3-Oxo-3-(((2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-methoxytetrahydro-2H-pyran-2-yl)methoxy)propanoic acid, 3-oxo-3-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-methoxyoxan-2-yl]methoxy]propanoic acid
| Molecular Formula | C10H16O9 |
|---|---|
| Molecular Weight | 280.08 g/mol |
| LogP | -2.5417 |
| Topological Polar Surface Area | 142.75 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 280.07944 |
| Heavy Atoms | 19 |
| Complexity | 328.962 |
Chemical Identifiers
| CAS Number | 79384-28-4 |
|---|---|
| SMILES | CO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)COC(=O)CC(=O)O)O)O)O |
Product Overview
6-O-malonyl-beta-methyl-D-glucopyranoside (CAS 79384-28-4), with molecular formula C10H16O9 and molecular weight 280.08 g/mol. IUPAC: 3-oxo-3-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-methoxyoxan-2-yl]methoxy]propanoic acid.
Chemical Property Profile of 6-O-malonyl-beta-methyl-D-glucopyranoside
Property Insights of 6-O-malonyl-beta-methyl-D-glucopyranoside
The XLogP value of -2.5417 indicates that 6-O-malonyl-beta-methyl-D-glucopyranoside is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 142.75 Ų indicates high polarity, suggesting 6-O-malonyl-beta-methyl-D-glucopyranoside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 6-O-malonyl-beta-methyl-D-glucopyranoside has 4 hydrogen bond donor(s) and 8 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-O-malonyl-beta-methyl-D-glucopyranoside?
The CAS number of 6-O-malonyl-beta-methyl-D-glucopyranoside is 79384-28-4.
What is the molecular formula of 6-O-malonyl-beta-methyl-D-glucopyranoside?
The molecular formula of 6-O-malonyl-beta-methyl-D-glucopyranoside is C10H16O9.
What is the molecular weight of 6-O-malonyl-beta-methyl-D-glucopyranoside?
The molecular weight of 6-O-malonyl-beta-methyl-D-glucopyranoside is 280.08 g/mol.
Where can I buy 6-O-malonyl-beta-methyl-D-glucopyranoside?
You can request a quote for 6-O-malonyl-beta-methyl-D-glucopyranoside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-O-malonyl-beta-methyl-D-glucopyranoside?
Yes, KEHONG BIO provides custom synthesis services for 6-O-malonyl-beta-methyl-D-glucopyranoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.