Obtusin
TL;DR: Obtusin (CAS 70588-05-5) is a chemical compound with molecular formula C18H16O7 and molecular weight 344.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,7-dihydroxy-2,3,8-trimethoxy-6-methylanthracene-9,10-dione
Also Known As: Obtusin, 1,7-dihydroxy-2,3,8-trimethoxy-6-methylanthracene-9,10-dione, HY-N6057, 0934AC, 4CH-024755
| Molecular Formula | C18H16O7 |
|---|---|
| Molecular Weight | 344.09 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 102.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 344.0896 |
| Heavy Atoms | 25 |
| Complexity | 536.0 |
Chemical Identifiers
| CAS Number | 70588-05-5 |
|---|---|
| SMILES | CC1=CC2=C(C(=C1O)OC)C(=O)C3=C(C(=C(C=C3C2=O)OC)OC)O |
| InChIKey | CFLNHFUPWNRWJA-UHFFFAOYSA-N |
Product Overview
Obtusin (CAS 70588-05-5), with molecular formula C18H16O7 and molecular weight 344.09 g/mol. IUPAC: 1,7-dihydroxy-2,3,8-trimethoxy-6-methylanthracene-9,10-dione.
Chemical Property Profile of Obtusin
Property Insights of Obtusin
The XLogP value of 3.0 indicates that Obtusin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Obtusin. Following Lipinski's Rule of Five, Obtusin has 2 hydrogen bond donor(s) and 7 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 Obtusin?
The CAS number of Obtusin is 70588-05-5.
What is the molecular formula of Obtusin?
The molecular formula of Obtusin is C18H16O7.
What is the molecular weight of Obtusin?
The molecular weight of Obtusin is 344.09 g/mol.
Where can I buy Obtusin?
You can request a quote for Obtusin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Obtusin?
Yes, KEHONG BIO provides custom synthesis services for Obtusin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.