6-Deoxyglucosone
TL;DR: 6-Deoxyglucosone (CAS 54166-09-5) is a chemical compound with molecular formula C6H10O5 and molecular weight 162.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3R,4S,5S)-3,4,5-trihydroxy-2-oxohexanal
Also Known As: 6-Deoxyglucosone, 6-deoxyhexos-2-ulose, L-arabino-Hexos-2-ulose, 6-deoxy-, (3R,4S,5S)-3,4,5-trihydroxy-2-oxohexanal, 7-((1S,2R,4aS,6S,8aR)-2,6-Dihydroxy-2,5,5,8a-tetramethyl-decahydro-naphthalen-1-ylmethoxy)-chromen-2-one
| Molecular Formula | C6H10O5 |
|---|---|
| Molecular Weight | 162.05 g/mol |
| LogP | -1.9 |
| Topological Polar Surface Area | 94.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 162.05283 |
| Heavy Atoms | 11 |
| Complexity | 155.0 |
Chemical Identifiers
| CAS Number | 54166-09-5 |
|---|---|
| SMILES | C[C@@H]([C@@H]([C@H](C(=O)C=O)O)O)O |
| InChIKey | JMKYUOVNRCMPDL-FUTKDDECSA-N |
Product Overview
6-Deoxyglucosone (CAS 54166-09-5), with molecular formula C6H10O5 and molecular weight 162.05 g/mol. IUPAC: (3R,4S,5S)-3,4,5-trihydroxy-2-oxohexanal.
Chemical Property Profile of 6-Deoxyglucosone
Property Insights of 6-Deoxyglucosone
The XLogP value of -1.9 indicates that 6-Deoxyglucosone is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 94.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Deoxyglucosone. Following Lipinski's Rule of Five, 6-Deoxyglucosone has 3 hydrogen bond donor(s) and 5 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-Deoxyglucosone?
The CAS number of 6-Deoxyglucosone is 54166-09-5.
What is the molecular formula of 6-Deoxyglucosone?
The molecular formula of 6-Deoxyglucosone is C6H10O5.
What is the molecular weight of 6-Deoxyglucosone?
The molecular weight of 6-Deoxyglucosone is 162.05 g/mol.
Where can I buy 6-Deoxyglucosone?
You can request a quote for 6-Deoxyglucosone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Deoxyglucosone?
Yes, KEHONG BIO provides custom synthesis services for 6-Deoxyglucosone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.