Andinermal A
TL;DR: Andinermal A (CAS 399023-88-2) is a chemical compound with molecular formula C18H16O7 and molecular weight 344.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-hydroxy-2-(3-hydroxy-2,4-dimethoxyphenyl)-6-methoxy-1-benzofuran-3-carbaldehyde
Also Known As: Andinermal A, Andinermal, J1.661.930B, 4-hydroxy-2-(3-hydroxy-2,4-dimethoxyphenyl)-6-methoxy-1-benzofuran-3-carbaldehyde, 2-(2',4'-Dimethoxy-3'-hydroxyphenyl)-4-hydroxy-6-methoxy-benzofuran-3-carbaldehyde
| Molecular Formula | C18H16O7 |
|---|---|
| Molecular Weight | 344.09 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 98.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 344.0896 |
| Heavy Atoms | 25 |
| Complexity | 459.0 |
Chemical Identifiers
| CAS Number | 399023-88-2 |
|---|---|
| SMILES | COC1=C(C(=C(C=C1)C2=C(C3=C(C=C(C=C3O2)OC)O)C=O)OC)O |
| InChIKey | XDUYDNPZEINTJY-UHFFFAOYSA-N |
Product Overview
Andinermal A (CAS 399023-88-2), with molecular formula C18H16O7 and molecular weight 344.09 g/mol. IUPAC: 4-hydroxy-2-(3-hydroxy-2,4-dimethoxyphenyl)-6-methoxy-1-benzofuran-3-carbaldehyde.
Chemical Property Profile of Andinermal A
Property Insights of Andinermal A
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Andinermal A. The TPSA of 98.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Andinermal A. Following Lipinski's Rule of Five, Andinermal A has 2 hydrogen bond donor(s) and 7 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 Andinermal A?
The CAS number of Andinermal A is 399023-88-2.
What is the molecular formula of Andinermal A?
The molecular formula of Andinermal A is C18H16O7.
What is the molecular weight of Andinermal A?
The molecular weight of Andinermal A is 344.09 g/mol.
Where can I buy Andinermal A?
You can request a quote for Andinermal A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Andinermal A?
Yes, KEHONG BIO provides custom synthesis services for Andinermal A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.