4,6-Dideoxy-4-malonylaminoglucose
TL;DR: 4,6-Dideoxy-4-malonylaminoglucose (CAS 1824-72-2) is a chemical compound with molecular formula C17H27NO12 and molecular weight 437.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[(2R,3R,4S,5R,6R)-4-[(2S,3R,4R,5R,6S)-3-acetyloxy-4,5-dihydroxy-6-methyloxan-2-yl]oxy-5,6-dihydroxy-2-methyloxan-3-yl]amino]-3-oxopropanoic acid
Also Known As: Qui4NMal, 4,6-Dideoxy-4-malonylaminoglucose, 4,6-Dideoxy-4-malonylamino-D-glucose, 3-[[(2R,3R,4S,5R,6R)-4-[(2S,3R,4R,5R,6S)-3-acetyloxy-4,5-dihydroxy-6-methyloxan-2-yl]oxy-5,6-dihydroxy-2-methyloxan-3-yl]amino]-3-oxopropanoic acid, 3-o-(2-o-acetyl-6-deoxy-
| Molecular Formula | C17H27NO12 |
|---|---|
| Molecular Weight | 437.15 g/mol |
| LogP | -2.4 |
| Topological Polar Surface Area | 201.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 7 |
| Exact Mass | 437.15332 |
| Heavy Atoms | 30 |
| Complexity | 644.0 |
Chemical Identifiers
| CAS Number | 1824-72-2 |
|---|---|
| SMILES | C[C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)O)O)O[C@H]2[C@@H]([C@@H]([C@H]([C@@H](O2)C)O)O)OC(=O)C)NC(=O)CC(=O)O |
| InChIKey | YEXKHDSGIBZZPH-FSIRCQHCSA-N |
Product Overview
4,6-Dideoxy-4-malonylaminoglucose (CAS 1824-72-2), with molecular formula C17H27NO12 and molecular weight 437.15 g/mol. IUPAC: 3-[[(2R,3R,4S,5R,6R)-4-[(2S,3R,4R,5R,6S)-3-acetyloxy-4,5-dihydroxy-6-methyloxan-2-yl]oxy-5,6-dihydroxy-2-methyloxan-3-yl]amino]-3-oxopropanoic acid.
Chemical Property Profile of 4,6-Dideoxy-4-malonylaminoglucose
Property Insights of 4,6-Dideoxy-4-malonylaminoglucose
The XLogP value of -2.4 indicates that 4,6-Dideoxy-4-malonylaminoglucose is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 201.0 Ų indicates high polarity, suggesting 4,6-Dideoxy-4-malonylaminoglucose may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4,6-Dideoxy-4-malonylaminoglucose has 6 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4,6-Dideoxy-4-malonylaminoglucose?
The CAS number of 4,6-Dideoxy-4-malonylaminoglucose is 1824-72-2.
What is the molecular formula of 4,6-Dideoxy-4-malonylaminoglucose?
The molecular formula of 4,6-Dideoxy-4-malonylaminoglucose is C17H27NO12.
What is the molecular weight of 4,6-Dideoxy-4-malonylaminoglucose?
The molecular weight of 4,6-Dideoxy-4-malonylaminoglucose is 437.15 g/mol.
Where can I buy 4,6-Dideoxy-4-malonylaminoglucose?
You can request a quote for 4,6-Dideoxy-4-malonylaminoglucose directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,6-Dideoxy-4-malonylaminoglucose?
Yes, KEHONG BIO provides custom synthesis services for 4,6-Dideoxy-4-malonylaminoglucose and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.