Gunacin
TL;DR: Gunacin (CAS 73341-70-5) is a chemical compound with molecular formula C17H16O8 and molecular weight 348.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3,6-dihydroxy-8-methoxy-2-methyl-5,10-dioxo-3,4-dihydro-2H-benzo[g]chromen-4-yl) acetate
Also Known As: Gunacin, 5-18-05-00435 (Beilstein Handbook Reference), 2H-Naphtho(2,3-b)pyran-5,10-dione, 3,4-dihydro-4-(acetyloxy)-3,6-dihydroxy-8-methoxy-2-methyl-, 2H-Naphtho(2,3-b)pyran-5,10-dione, 4-(acetyloxy)-3,4-dihydro-3,6-dihydroxy-8-methoxy-2-methyl-, (3,6-dihydroxy-8-methoxy-2-methyl-5,10-dioxo-3,4-dihydro-2H-benzo[g]chromen-4-yl) acetate
| Molecular Formula | C17H16O8 |
|---|---|
| Molecular Weight | 348.08 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 119.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 348.0845 |
| Heavy Atoms | 25 |
| Complexity | 639.0 |
Chemical Identifiers
| CAS Number | 73341-70-5 |
|---|---|
| SMILES | CC1C(C(C2=C(O1)C(=O)C3=C(C2=O)C(=CC(=C3)OC)O)OC(=O)C)O |
| InChIKey | GEQDLVXKRXTSSY-UHFFFAOYSA-N |
Product Overview
Gunacin (CAS 73341-70-5), with molecular formula C17H16O8 and molecular weight 348.08 g/mol. IUPAC: (3,6-dihydroxy-8-methoxy-2-methyl-5,10-dioxo-3,4-dihydro-2H-benzo[g]chromen-4-yl) acetate.
Chemical Property Profile of Gunacin
Property Insights of Gunacin
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Gunacin. The TPSA of 119.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Gunacin. Following Lipinski's Rule of Five, Gunacin has 2 hydrogen bond donor(s) and 8 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 Gunacin?
The CAS number of Gunacin is 73341-70-5.
What is the molecular formula of Gunacin?
The molecular formula of Gunacin is C17H16O8.
What is the molecular weight of Gunacin?
The molecular weight of Gunacin is 348.08 g/mol.
Where can I buy Gunacin?
You can request a quote for Gunacin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Gunacin?
Yes, KEHONG BIO provides custom synthesis services for Gunacin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.