Chrysoobtusin
TL;DR: Chrysoobtusin (CAS 70588-06-6) is a chemical compound with molecular formula C19H18O7 and molecular weight 358.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxy-1,6,7,8-tetramethoxy-3-methylanthracene-9,10-dione
Also Known As: Chrysoobtusin, Chryso-obtusin, 2-hydroxy-1,6,7,8-tetramethoxy-3-methylanthracene-9,10-dione, 9,10-Anthracenedione, 2-hydroxy-1,6,7,8-tetramethoxy-3-methyl-, 2-hydroxy-1,6,7,8-tetramethoxy-3-methylanthraquinone
| Molecular Formula | C19H18O7 |
|---|---|
| Molecular Weight | 358.11 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 91.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 358.10526 |
| Heavy Atoms | 26 |
| Complexity | 550.0 |
| Melting Point | 219 - 220 °C |
Chemical Identifiers
| CAS Number | 70588-06-6 |
|---|---|
| SMILES | CC1=CC2=C(C(=C1O)OC)C(=O)C3=C(C(=C(C=C3C2=O)OC)OC)OC |
| InChIKey | ZMDXTRSTKHTSCE-UHFFFAOYSA-N |
Product Overview
Chrysoobtusin (CAS 70588-06-6), with molecular formula C19H18O7 and molecular weight 358.11 g/mol. IUPAC: 2-hydroxy-1,6,7,8-tetramethoxy-3-methylanthracene-9,10-dione.
Chemical Property Profile of Chrysoobtusin
Property Insights of Chrysoobtusin
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Chrysoobtusin. The TPSA of 91.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Chrysoobtusin. Following Lipinski's Rule of Five, Chrysoobtusin has 1 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 Chrysoobtusin?
The CAS number of Chrysoobtusin is 70588-06-6.
What is the molecular formula of Chrysoobtusin?
The molecular formula of Chrysoobtusin is C19H18O7.
What is the molecular weight of Chrysoobtusin?
The molecular weight of Chrysoobtusin is 358.11 g/mol.
Where can I buy Chrysoobtusin?
You can request a quote for Chrysoobtusin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Chrysoobtusin?
Yes, KEHONG BIO provides custom synthesis services for Chrysoobtusin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.