芥子酸酰基-β-D-葡萄糖苷
TL;DR: 芥子酸酰基-β-D-葡萄糖苷 (CAS 14364-09-1) is a chemical compound with molecular formula C17H22O10 and molecular weight 386.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
芥子酸酰基-β-D-葡萄糖苷
[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoate
Also Known As: Sinapic Acid Acyl-b-D-glucoside, (2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl 3-(4-hydroxy-3,5-dimethoxyphenyl)acrylate
| Molecular Formula | C17H22O10 |
|---|---|
| Molecular Weight | 386.12 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 155.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 7 |
| Exact Mass | 386.1213 |
| Heavy Atoms | 27 |
| Complexity | 498.0 |
Chemical Identifiers
| CAS Number | 14364-09-1 |
|---|---|
| SMILES | COC1=CC(=CC(=C1O)OC)C=CC(=O)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O |
| InChIKey | XRKBRPFTFKKHEF-UFRBAHOGSA-N |
Product Overview
芥子酸酰基-β-D-葡萄糖苷 (CAS 14364-09-1), with molecular formula C17H22O10 and molecular weight 386.12 g/mol. IUPAC: [(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoate.
Chemical Property Profile of 芥子酸酰基-β-D-葡萄糖苷
Property Insights of 芥子酸酰基-β-D-葡萄糖苷
The XLogP value of -0.3 indicates that 芥子酸酰基-β-D-葡萄糖苷 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 155.0 Ų indicates high polarity, suggesting 芥子酸酰基-β-D-葡萄糖苷 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 芥子酸酰基-β-D-葡萄糖苷 has 5 hydrogen bond donor(s) and 10 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 芥子酸酰基-β-D-葡萄糖苷?
The CAS number of 芥子酸酰基-β-D-葡萄糖苷 is 14364-09-1.
What is the molecular formula of 芥子酸酰基-β-D-葡萄糖苷?
The molecular formula of 芥子酸酰基-β-D-葡萄糖苷 is C17H22O10.
What is the molecular weight of 芥子酸酰基-β-D-葡萄糖苷?
The molecular weight of 芥子酸酰基-β-D-葡萄糖苷 is 386.12 g/mol.
Where can I buy 芥子酸酰基-β-D-葡萄糖苷?
You can request a quote for 芥子酸酰基-β-D-葡萄糖苷 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 芥子酸酰基-β-D-葡萄糖苷?
Yes, KEHONG BIO provides custom synthesis services for 芥子酸酰基-β-D-葡萄糖苷 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.