欧鼠李苷 A
TL;DR: 欧鼠李苷 A (CAS 521-62-0) is a chemical compound with molecular formula C21H20O9 and molecular weight 416.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
欧鼠李苷 A
1,8-dihydroxy-3-methyl-6-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyanthracene-9,10-dione
Also Known As: Frangulin A, Franguloside, Rhamnoxanthin, Emodin-L-rhamnoside, FRANGULIN A [MI]
| Molecular Formula | C21H20O9 |
|---|---|
| Molecular Weight | 416.11 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 154.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 2 |
| Exact Mass | 416.11072 |
| Heavy Atoms | 30 |
| Complexity | 683.0 |
Chemical Identifiers
| CAS Number | 521-62-0 |
|---|---|
| SMILES | C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OC2=CC3=C(C(=C2)O)C(=O)C4=C(C3=O)C=C(C=C4O)C)O)O)O |
| InChIKey | DTTVUKLWJFJOHO-FUCRAMRQSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
欧鼠李苷 A (CAS 521-62-0), with molecular formula C21H20O9 and molecular weight 416.11 g/mol. IUPAC: 1,8-dihydroxy-3-methyl-6-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyanthracene-9,10-dione.
Chemical Property Profile of 欧鼠李苷 A
Property Insights of 欧鼠李苷 A
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 欧鼠李苷 A. The TPSA of 154.0 Ų indicates high polarity, suggesting 欧鼠李苷 A may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 欧鼠李苷 A has 5 hydrogen bond donor(s) and 9 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 欧鼠李苷 A?
The CAS number of 欧鼠李苷 A is 521-62-0.
What is the molecular formula of 欧鼠李苷 A?
The molecular formula of 欧鼠李苷 A is C21H20O9.
What is the molecular weight of 欧鼠李苷 A?
The molecular weight of 欧鼠李苷 A is 416.11 g/mol.
Where can I buy 欧鼠李苷 A?
You can request a quote for 欧鼠李苷 A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 欧鼠李苷 A?
Yes, KEHONG BIO provides custom synthesis services for 欧鼠李苷 A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.