5-Deoxyfusarubin
TL;DR: 5-Deoxyfusarubin (CAS 132899-05-9) is a chemical compound with molecular formula C15H14O6 and molecular weight 290.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,9-dihydroxy-7-methoxy-3-methyl-1,4-dihydrobenzo[g]isochromene-5,10-dione
Also Known As: 5-Deoxyfusarubin, Deoxyfusarubin, 9-desmethylherbarine, 9-Desmethylberbarine, 6-O-Demethyl-5-deoxyfusarubin
| Molecular Formula | C15H14O6 |
|---|---|
| Molecular Weight | 290.08 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 93.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 290.07904 |
| Heavy Atoms | 21 |
| Complexity | 524.0 |
Chemical Identifiers
| CAS Number | 132899-05-9 |
|---|---|
| SMILES | CC1(CC2=C(CO1)C(=O)C3=C(C2=O)C=C(C=C3O)OC)O |
| InChIKey | RYQOFJPFFVZQTC-UHFFFAOYSA-N |
Product Overview
5-Deoxyfusarubin (CAS 132899-05-9), with molecular formula C15H14O6 and molecular weight 290.08 g/mol. IUPAC: 3,9-dihydroxy-7-methoxy-3-methyl-1,4-dihydrobenzo[g]isochromene-5,10-dione.
Chemical Property Profile of 5-Deoxyfusarubin
Property Insights of 5-Deoxyfusarubin
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Deoxyfusarubin. The TPSA of 93.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Deoxyfusarubin. Following Lipinski's Rule of Five, 5-Deoxyfusarubin has 2 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 5-Deoxyfusarubin?
The CAS number of 5-Deoxyfusarubin is 132899-05-9.
What is the molecular formula of 5-Deoxyfusarubin?
The molecular formula of 5-Deoxyfusarubin is C15H14O6.
What is the molecular weight of 5-Deoxyfusarubin?
The molecular weight of 5-Deoxyfusarubin is 290.08 g/mol.
Where can I buy 5-Deoxyfusarubin?
You can request a quote for 5-Deoxyfusarubin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Deoxyfusarubin?
Yes, KEHONG BIO provides custom synthesis services for 5-Deoxyfusarubin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.