Dihydro Atranorin
TL;DR: Dihydro Atranorin (CAS 69168-12-3) is a chemical compound with molecular formula C19H20O8 and molecular weight 376.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-hydroxy-4-methoxycarbonyl-2,5-dimethylphenyl) 2,4-dihydroxy-3-(hydroxymethyl)-6-methylbenzoate
Also Known As: Dihydroatranorin, Dihydro Atranorin, proatranorin IV, KBio2_007599, DivK1c_006976
| Molecular Formula | C19H20O8 |
|---|---|
| Molecular Weight | 376.12 g/mol |
| LogP | 2.22676 |
| Topological Polar Surface Area | 133.52 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 376.1158 |
| Heavy Atoms | 27 |
| Complexity | 930.2825 |
Chemical Identifiers
| CAS Number | 69168-12-3 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1C(=O)OC2=C(C(=C(C(=C2)C)C(=O)OC)O)C)O)CO)O |
Product Overview
Dihydro Atranorin (CAS 69168-12-3), with molecular formula C19H20O8 and molecular weight 376.12 g/mol. IUPAC: (3-hydroxy-4-methoxycarbonyl-2,5-dimethylphenyl) 2,4-dihydroxy-3-(hydroxymethyl)-6-methylbenzoate.
Chemical Property Profile of Dihydro Atranorin
Property Insights of Dihydro Atranorin
The XLogP value of 2.22676 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dihydro Atranorin. The TPSA of 133.52 Ų falls within the moderate polarity range, balancing permeability and solubility for Dihydro Atranorin. Following Lipinski's Rule of Five, Dihydro Atranorin has 4 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 Dihydro Atranorin?
The CAS number of Dihydro Atranorin is 69168-12-3.
What is the molecular formula of Dihydro Atranorin?
The molecular formula of Dihydro Atranorin is C19H20O8.
What is the molecular weight of Dihydro Atranorin?
The molecular weight of Dihydro Atranorin is 376.12 g/mol.
Where can I buy Dihydro Atranorin?
You can request a quote for Dihydro Atranorin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dihydro Atranorin?
Yes, KEHONG BIO provides custom synthesis services for Dihydro Atranorin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.