Aristolic Acid
TL;DR: Aristolic Acid (CAS 35142-05-3) is a chemical compound with molecular formula C17H12O5 and molecular weight 296.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-methoxynaphtho[2,1-g][1,3]benzodioxole-5-carboxylic acid
Also Known As: Aristolic acid, denitroaristolochic acid, 8-methoxynaphtho[2,1-g][1,3]benzodioxole-5-carboxylic acid, Phenanthro(3,4-d)-1,3-dioxole-5-carboxylic acid, 8-methoxy-, 8-methoxyphenanthro[3,4-d][1,3]dioxole-5-carboxylic acid
| Molecular Formula | C17H12O5 |
|---|---|
| Molecular Weight | 296.07 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 65.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 296.06848 |
| Heavy Atoms | 22 |
| Complexity | 439.0 |
Chemical Identifiers
| CAS Number | 35142-05-3 |
|---|---|
| SMILES | COC1=CC=CC2=C1C=CC3=C2C4=C(C=C3C(=O)O)OCO4 |
| InChIKey | WNMKOPJJPJHXJX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Aristolic Acid (CAS 35142-05-3), with molecular formula C17H12O5 and molecular weight 296.07 g/mol. IUPAC: 8-methoxynaphtho[2,1-g][1,3]benzodioxole-5-carboxylic acid.
Chemical Property Profile of Aristolic Acid
Property Insights of Aristolic Acid
The XLogP value of 3.7 indicates that Aristolic Acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Aristolic Acid. Following Lipinski's Rule of Five, Aristolic Acid has 1 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 Aristolic Acid?
The CAS number of Aristolic Acid is 35142-05-3.
What is the molecular formula of Aristolic Acid?
The molecular formula of Aristolic Acid is C17H12O5.
What is the molecular weight of Aristolic Acid?
The molecular weight of Aristolic Acid is 296.07 g/mol.
Where can I buy Aristolic Acid?
You can request a quote for Aristolic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Aristolic Acid?
Yes, KEHONG BIO provides custom synthesis services for Aristolic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.