beta-D-Glucopyranuronic acid, 1-cyclohexanecarboxylate
TL;DR: beta-D-Glucopyranuronic acid, 1-cyclohexanecarboxylate (CAS 73094-36-7) is a chemical compound with molecular formula C13H20O8 and molecular weight 304.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3S,4S,5R,6S)-6-(cyclohexanecarbonyloxy)-3,4,5-trihydroxyoxane-2-carboxylic acid
Also Known As: Cyclohexylcarbonyl beta-D-glucuronide, 1-O-(Cyclohexanecarbonyl)hexopyranuronic acid, 1-o-(cyclohexylcarbonyl)-, A-d-glucopyranuronic acid, beta-D-Glucopyranuronic acid, 1-cyclohexanecarboxylate
| Molecular Formula | C13H20O8 |
|---|---|
| Molecular Weight | 304.12 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 134.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 304.1158 |
| Heavy Atoms | 21 |
| Complexity | 392.0 |
Chemical Identifiers
| CAS Number | 73094-36-7 |
|---|---|
| SMILES | C1CCC(CC1)C(=O)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C(=O)O)O)O)O |
| InChIKey | OTFWAAARSNPHTE-UNLLLRGISA-N |
Product Overview
beta-D-Glucopyranuronic acid, 1-cyclohexanecarboxylate (CAS 73094-36-7), with molecular formula C13H20O8 and molecular weight 304.12 g/mol. IUPAC: (2S,3S,4S,5R,6S)-6-(cyclohexanecarbonyloxy)-3,4,5-trihydroxyoxane-2-carboxylic acid.
Chemical Property Profile of beta-D-Glucopyranuronic acid, 1-cyclohexanecarboxylate
Property Insights of beta-D-Glucopyranuronic acid, 1-cyclohexanecarboxylate
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for beta-D-Glucopyranuronic acid, 1-cyclohexanecarboxylate. The TPSA of 134.0 Ų falls within the moderate polarity range, balancing permeability and solubility for beta-D-Glucopyranuronic acid, 1-cyclohexanecarboxylate. Following Lipinski's Rule of Five, beta-D-Glucopyranuronic acid, 1-cyclohexanecarboxylate 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 beta-D-Glucopyranuronic acid, 1-cyclohexanecarboxylate?
The CAS number of beta-D-Glucopyranuronic acid, 1-cyclohexanecarboxylate is 73094-36-7.
What is the molecular formula of beta-D-Glucopyranuronic acid, 1-cyclohexanecarboxylate?
The molecular formula of beta-D-Glucopyranuronic acid, 1-cyclohexanecarboxylate is C13H20O8.
What is the molecular weight of beta-D-Glucopyranuronic acid, 1-cyclohexanecarboxylate?
The molecular weight of beta-D-Glucopyranuronic acid, 1-cyclohexanecarboxylate is 304.12 g/mol.
Where can I buy beta-D-Glucopyranuronic acid, 1-cyclohexanecarboxylate?
You can request a quote for beta-D-Glucopyranuronic acid, 1-cyclohexanecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for beta-D-Glucopyranuronic acid, 1-cyclohexanecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for beta-D-Glucopyranuronic acid, 1-cyclohexanecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.