Austrocortirubin
TL;DR: Austrocortirubin (CAS 112926-20-2) is a chemical compound with molecular formula C16H16O7 and molecular weight 320.0896 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(7S)-5,7,9,10-tetrahydroxy-2-methoxy-7-methyl-6,8-dihydro-5H-anthracene-1,4-dione
Also Known As: Austrocortirubin, (1S,3S)-Austrocortirubin, NCI60_008303, (7S)-5,7,9,10-tetrahydroxy-2-methoxy-7-methyl-6,8-dihydro-5H-anthracene-1,4-dione, (7S)-5,7,9,10-Tetrahydroxy-2-methoxy-7-methyl-5,6,7,8-tetrahydroanthracene-1,4-dione
Technical Specifications
| Molecular Formula | C16H16O7 |
| Molecular Weight | 320.0896 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 124.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 320.0896 Da |
| Heavy Atoms | 23 |
| Complexity | 571.0 |
| SMILES | C[C@]1(CC(C2=C(C1)C(=C3C(=C2O)C(=O)C=C(C3=O)OC)O)O)O |
| InChIKey | WWTHHBSODPGTAK-VEDISBKWSA-N |
Chemical Property Profile of Austrocortirubin
Property Insights of Austrocortirubin
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Austrocortirubin. The TPSA of 124.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Austrocortirubin. Following Lipinski's Rule of Five, Austrocortirubin has 4 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Austrocortirubin?
The CAS number of Austrocortirubin is 112926-20-2.
What is the molecular formula of Austrocortirubin?
The molecular formula of Austrocortirubin is C16H16O7.
What is the molecular weight of Austrocortirubin?
The molecular weight of Austrocortirubin is 320.0896 g/mol.
Where can I buy Austrocortirubin?
You can request a quote for Austrocortirubin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Austrocortirubin?
Yes, CoreyChem provides custom synthesis services for Austrocortirubin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.