Obionin A
TL;DR: Obionin A (CAS 125287-04-9) is a chemical compound with molecular formula C21H24O5 and molecular weight 356.16238 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
10-hydroxy-7-methoxy-3-(4-methylhexan-2-yl)-1H-benzo[g]isochromene-8,9-dione
Also Known As: Obionin A, 10-hydroxy-7-methoxy-3-(4-methylhexan-2-yl)-1H-benzo[g]isochromene-8,9-dione, 10-hydroxy-7-methoxy-3-(4-methylhexan-2-yl)-1H-benzo(g)isochromene-8,9-dione, 10-Hydroxy-7-methoxy-3-(4-methylhexan-2-yl)-1H-naphtho[2,3-c]pyran-8,9-dione, 1H-Naphtho(2,3-c)pyran-8,9-dione, 3-(1,3-dimethylpentyl)-10-hydroxy-7-methoxy-
Technical Specifications
| Molecular Formula | C21H24O5 |
| Molecular Weight | 356.16238 g/mol |
| XLogP | 4.7 |
| Topological Polar Surface Area (TPSA) | 72.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 356.16238 Da |
| Heavy Atoms | 26 |
| Complexity | 634.0 |
| SMILES | CCC(C)CC(C)C1=CC2=C(CO1)C(=C3C(=C2)C=C(C(=O)C3=O)OC)O |
| InChIKey | BRHYSVIYRNFZEB-UHFFFAOYSA-N |
Chemical Property Profile of Obionin A
Property Insights of Obionin A
The XLogP value of 4.7 indicates that Obionin A is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Obionin A. Following Lipinski's Rule of Five, Obionin A has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Obionin A?
The CAS number of Obionin A is 125287-04-9.
What is the molecular formula of Obionin A?
The molecular formula of Obionin A is C21H24O5.
What is the molecular weight of Obionin A?
The molecular weight of Obionin A is 356.16238 g/mol.
Where can I buy Obionin A?
You can request a quote for Obionin A directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Obionin A?
Yes, CoreyChem provides custom synthesis services for Obionin A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.