金雉菊素
TL;DR: 金雉菊素 (CAS 486-24-8) is a chemical compound with molecular formula C16H12O6 and molecular weight 300.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
金雉菊素
2-[(3,4-dihydroxyphenyl)methylidene]-6-hydroxy-7-methoxy-1-benzofuran-3-one
Also Known As: Leptosidin, 2-[(3,4-dihydroxyphenyl)methylidene]-6-hydroxy-7-methoxy-benzofuran-3-one, 2-[(3,4-dihydroxyphenyl)methylidene]-6-hydroxy-7-methoxy-1-benzofuran-3-one
| Molecular Formula | C16H12O6 |
|---|---|
| Molecular Weight | 300.06 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 96.2 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 300.0634 |
| Heavy Atoms | 22 |
| Complexity | 462.0 |
Chemical Identifiers
| CAS Number | 486-24-8 |
|---|---|
| SMILES | COC1=C(C=CC2=C1OC(=CC3=CC(=C(C=C3)O)O)C2=O)O |
| InChIKey | PFRGTMTYWMVLMU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
金雉菊素 (CAS 486-24-8), with molecular formula C16H12O6 and molecular weight 300.06 g/mol. IUPAC: 2-[(3,4-dihydroxyphenyl)methylidene]-6-hydroxy-7-methoxy-1-benzofuran-3-one.
Chemical Property Profile of 金雉菊素
Property Insights of 金雉菊素
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 金雉菊素. The TPSA of 96.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 金雉菊素. Following Lipinski's Rule of Five, 金雉菊素 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 金雉菊素?
The CAS number of 金雉菊素 is 486-24-8.
What is the molecular formula of 金雉菊素?
The molecular formula of 金雉菊素 is C16H12O6.
What is the molecular weight of 金雉菊素?
The molecular weight of 金雉菊素 is 300.06 g/mol.
Where can I buy 金雉菊素?
You can request a quote for 金雉菊素 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 金雉菊素?
Yes, KEHONG BIO provides custom synthesis services for 金雉菊素 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.