Obtusinin
TL;DR: Obtusinin (CAS 131916-89-7) is a chemical compound with molecular formula C15H18O6 and molecular weight 294.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(2,3-dihydroxy-3-methylbutoxy)-6-methoxychromen-2-one
Also Known As: Obtusinin, MEGxp0_000884, ACon1_000645, 7-(2,3-dihydroxy-3-methylbutoxy)-6-methoxychromen-2-one, 7-(2,3-dihydroxy-3-methylbutoxy)-6-methoxy-2H-chromen-2-one
| Molecular Formula | C15H18O6 |
|---|---|
| Molecular Weight | 294.11 g/mol |
| LogP | 1.3122 |
| Topological Polar Surface Area | 89.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 294.11035 |
| Heavy Atoms | 21 |
| Complexity | 682.6038 |
Chemical Identifiers
| CAS Number | 131916-89-7 |
|---|---|
| SMILES | CC(C)(C(COC1=C(C=C2C=CC(=O)OC2=C1)OC)O)O |
Product Overview
Obtusinin (CAS 131916-89-7), with molecular formula C15H18O6 and molecular weight 294.11 g/mol. IUPAC: 7-(2,3-dihydroxy-3-methylbutoxy)-6-methoxychromen-2-one.
Chemical Property Profile of Obtusinin
Property Insights of Obtusinin
The XLogP value of 1.3122 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Obtusinin. The TPSA of 89.13 Ų falls within the moderate polarity range, balancing permeability and solubility for Obtusinin. Following Lipinski's Rule of Five, Obtusinin 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 Obtusinin?
The CAS number of Obtusinin is 131916-89-7.
What is the molecular formula of Obtusinin?
The molecular formula of Obtusinin is C15H18O6.
What is the molecular weight of Obtusinin?
The molecular weight of Obtusinin is 294.11 g/mol.
Where can I buy Obtusinin?
You can request a quote for Obtusinin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Obtusinin?
Yes, KEHONG BIO provides custom synthesis services for Obtusinin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.