3-脱氧-5-O-甲基甘露-2-辛酮糖酸
TL;DR: 3-脱氧-5-O-甲基甘露-2-辛酮糖酸 (CAS 1237-68-9) is a chemical compound with molecular formula C9H16O8 and molecular weight 252.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-脱氧-5-O-甲基甘露-2-辛酮糖酸
(4R,5R,6R,7R)-4,6,7,8-tetrahydroxy-5-methoxy-2-oxooctanoic acid
Also Known As: 3-Methyl-kdo, 3-Deoxy-5-O-methylmanno-2-octolusonic acid, 3-Deoxy-5-O-methyloct-2-ulosonic acid, 3-deoxy-5-o-methyl-d-manno-oct-2-ulosonic acid, 3-deoxy-5-O-methyl-manno-2-octulosonic acid
| Molecular Formula | C9H16O8 |
|---|---|
| Molecular Weight | 252.08 g/mol |
| LogP | -3.0 |
| Topological Polar Surface Area | 145.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 252.08452 |
| Heavy Atoms | 17 |
| Complexity | 266.0 |
Chemical Identifiers
| CAS Number | 1237-68-9 |
|---|---|
| SMILES | CO[C@H]([C@@H](CC(=O)C(=O)O)O)[C@@H]([C@@H](CO)O)O |
| InChIKey | HFBGCURPZAAYRW-XVFCMESISA-N |
Product Overview
3-脱氧-5-O-甲基甘露-2-辛酮糖酸 (CAS 1237-68-9), with molecular formula C9H16O8 and molecular weight 252.08 g/mol. IUPAC: (4R,5R,6R,7R)-4,6,7,8-tetrahydroxy-5-methoxy-2-oxooctanoic acid.
Chemical Property Profile of 3-脱氧-5-O-甲基甘露-2-辛酮糖酸
Property Insights of 3-脱氧-5-O-甲基甘露-2-辛酮糖酸
The XLogP value of -3.0 indicates that 3-脱氧-5-O-甲基甘露-2-辛酮糖酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 145.0 Ų indicates high polarity, suggesting 3-脱氧-5-O-甲基甘露-2-辛酮糖酸 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3-脱氧-5-O-甲基甘露-2-辛酮糖酸 has 5 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 3-脱氧-5-O-甲基甘露-2-辛酮糖酸?
The CAS number of 3-脱氧-5-O-甲基甘露-2-辛酮糖酸 is 1237-68-9.
What is the molecular formula of 3-脱氧-5-O-甲基甘露-2-辛酮糖酸?
The molecular formula of 3-脱氧-5-O-甲基甘露-2-辛酮糖酸 is C9H16O8.
What is the molecular weight of 3-脱氧-5-O-甲基甘露-2-辛酮糖酸?
The molecular weight of 3-脱氧-5-O-甲基甘露-2-辛酮糖酸 is 252.08 g/mol.
Where can I buy 3-脱氧-5-O-甲基甘露-2-辛酮糖酸?
You can request a quote for 3-脱氧-5-O-甲基甘露-2-辛酮糖酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-脱氧-5-O-甲基甘露-2-辛酮糖酸?
Yes, KEHONG BIO provides custom synthesis services for 3-脱氧-5-O-甲基甘露-2-辛酮糖酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.