8-Deoxy-11,13-dihydroxygrosheimin
TL;DR: 8-Deoxy-11,13-dihydroxygrosheimin (CAS 83551-03-5) is a chemical compound with molecular formula C15H20O5 and molecular weight 280.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-hydroxy-3-(hydroxymethyl)-9-methyl-6-methylidene-3a,4,5,6a,7,9,9a,9b-octahydroazuleno[4,5-b]furan-2,8-dione
Also Known As: 8-Deoxy-11,13-dihydroxygrosheimin, 3-hydroxy-3-(hydroxymethyl)-9-methyl-6-methylidene-3a,4,5,6a,7,9,9a,9b-octahydroazuleno[4,5-b]furan-2,8-dione, 11,13-Dihydroxy-3-oxo-10(14)guaien-12,6-olide - Cynara cardunculus (artichoke), 3-hydroxy-3-(hydroxymethyl)-9-methyl-6-methylene-3a,4,5,6a,7,9,9a,9b-octahydroazuleno[4,5-b]furan-2,8-dione, 3-hydroxy-3-(hydroxymethyl)-9-methyl-6-methylidene-3a,4,5,6a,7,9,9a,9b-octahydroazuleno[4,5-b]uran-2,8-dione
| Molecular Formula | C15H20O5 |
|---|---|
| Molecular Weight | 280.13 g/mol |
| LogP | 0.4427 |
| Topological Polar Surface Area | 83.83 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 280.13107 |
| Heavy Atoms | 20 |
| Complexity | 484.65555 |
Chemical Identifiers
| CAS Number | 83551-03-5 |
|---|---|
| SMILES | CC1C2C(CC1=O)C(=C)CCC3C2OC(=O)C3(CO)O |
Product Overview
8-Deoxy-11,13-dihydroxygrosheimin (CAS 83551-03-5), with molecular formula C15H20O5 and molecular weight 280.13 g/mol. IUPAC: 3-hydroxy-3-(hydroxymethyl)-9-methyl-6-methylidene-3a,4,5,6a,7,9,9a,9b-octahydroazuleno[4,5-b]furan-2,8-dione.
Chemical Property Profile of 8-Deoxy-11,13-dihydroxygrosheimin
Property Insights of 8-Deoxy-11,13-dihydroxygrosheimin
The XLogP value of 0.4427 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-Deoxy-11,13-dihydroxygrosheimin. The TPSA of 83.83 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-Deoxy-11,13-dihydroxygrosheimin. Following Lipinski's Rule of Five, 8-Deoxy-11,13-dihydroxygrosheimin has 2 hydrogen bond donor(s) and 5 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 8-Deoxy-11,13-dihydroxygrosheimin?
The CAS number of 8-Deoxy-11,13-dihydroxygrosheimin is 83551-03-5.
What is the molecular formula of 8-Deoxy-11,13-dihydroxygrosheimin?
The molecular formula of 8-Deoxy-11,13-dihydroxygrosheimin is C15H20O5.
What is the molecular weight of 8-Deoxy-11,13-dihydroxygrosheimin?
The molecular weight of 8-Deoxy-11,13-dihydroxygrosheimin is 280.13 g/mol.
Where can I buy 8-Deoxy-11,13-dihydroxygrosheimin?
You can request a quote for 8-Deoxy-11,13-dihydroxygrosheimin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-Deoxy-11,13-dihydroxygrosheimin?
Yes, KEHONG BIO provides custom synthesis services for 8-Deoxy-11,13-dihydroxygrosheimin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.