Carpusin
TL;DR: Carpusin (CAS 89648-35-1) is a chemical compound with molecular formula C16H14O6 and molecular weight 302.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-dihydroxy-2-[(4-hydroxyphenyl)methyl]-4-methoxy-1-benzofuran-3-one
Also Known As: Marsupsin, carpusin, Carasinaurone, Marsuosin, 2,6-dihydroxy-2-[(4-hydroxyphenyl)methyl]-4-methoxy-1-benzofuran-3-one
| Molecular Formula | C16H14O6 |
|---|---|
| Molecular Weight | 302.08 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 96.2 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 302.07904 |
| Heavy Atoms | 22 |
| Complexity | 419.0 |
Chemical Identifiers
| CAS Number | 89648-35-1 |
|---|---|
| SMILES | COC1=CC(=CC2=C1C(=O)C(O2)(CC3=CC=C(C=C3)O)O)O |
| InChIKey | IQTGAKWQIFFPQX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Carpusin (CAS 89648-35-1), with molecular formula C16H14O6 and molecular weight 302.08 g/mol. IUPAC: 2,6-dihydroxy-2-[(4-hydroxyphenyl)methyl]-4-methoxy-1-benzofuran-3-one.
Chemical Property Profile of Carpusin
Property Insights of Carpusin
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carpusin. The TPSA of 96.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Carpusin. Following Lipinski's Rule of Five, Carpusin has 3 hydrogen bond donor(s) and 6 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 Carpusin?
The CAS number of Carpusin is 89648-35-1.
What is the molecular formula of Carpusin?
The molecular formula of Carpusin is C16H14O6.
What is the molecular weight of Carpusin?
The molecular weight of Carpusin is 302.08 g/mol.
Where can I buy Carpusin?
You can request a quote for Carpusin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carpusin?
Yes, KEHONG BIO provides custom synthesis services for Carpusin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.