2,3-Dihydroauriculatin
TL;DR: 2,3-Dihydroauriculatin (CAS 115587-27-4) is a chemical compound with molecular formula C25H26O6 and molecular weight 422.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(2,4-dihydroxyphenyl)-5-hydroxy-2,2-dimethyl-10-(3-methylbut-2-enyl)-7,8-dihydropyrano[3,2-g]chromen-6-one
Also Known As: 2,3-Dihydroauriculatin, 7-(2,4-dihydroxyphenyl)-5-hydroxy-2,2-dimethyl-10-(3-methylbut-2-enyl)-7,8-dihydropyrano[3,2-g]chromen-6-one, 3-benzyl-5-(2-bromoethyl)-2-phenylimino-1,3-thiazolidin-4-one, 5,2',4'-Trihydroxy-8-prenyl-6'',6''-dimethylpyrano[2'',3'':7,6]isoflavanone, 2H,6H-Benzo[1,2-b:5,4-b']dipyran-6-one,7-(2,4-dihydroxyphenyl)-7,8-dihydro-5-hydroxy-2,2-dimethyl-10-(3-methyl-2-buten-1-yl)-
| Molecular Formula | C25H26O6 |
|---|---|
| Molecular Weight | 422.17 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 96.2 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 422.17294 |
| Heavy Atoms | 31 |
| Complexity | 738.0 |
Chemical Identifiers
| CAS Number | 115587-27-4 |
|---|---|
| SMILES | CC(=CCC1=C2C(=C(C3=C1OCC(C3=O)C4=C(C=C(C=C4)O)O)O)C=CC(O2)(C)C)C |
| InChIKey | QIUJXSRLJRBVHI-UHFFFAOYSA-N |
Product Overview
2,3-Dihydroauriculatin (CAS 115587-27-4), with molecular formula C25H26O6 and molecular weight 422.17 g/mol. IUPAC: 7-(2,4-dihydroxyphenyl)-5-hydroxy-2,2-dimethyl-10-(3-methylbut-2-enyl)-7,8-dihydropyrano[3,2-g]chromen-6-one.
Chemical Property Profile of 2,3-Dihydroauriculatin
Property Insights of 2,3-Dihydroauriculatin
The XLogP value of 5.4 indicates that 2,3-Dihydroauriculatin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,3-Dihydroauriculatin. Following Lipinski's Rule of Five, 2,3-Dihydroauriculatin has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,3-Dihydroauriculatin?
The CAS number of 2,3-Dihydroauriculatin is 115587-27-4.
What is the molecular formula of 2,3-Dihydroauriculatin?
The molecular formula of 2,3-Dihydroauriculatin is C25H26O6.
What is the molecular weight of 2,3-Dihydroauriculatin?
The molecular weight of 2,3-Dihydroauriculatin is 422.17 g/mol.
Where can I buy 2,3-Dihydroauriculatin?
You can request a quote for 2,3-Dihydroauriculatin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3-Dihydroauriculatin?
Yes, KEHONG BIO provides custom synthesis services for 2,3-Dihydroauriculatin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.