Deepoxydeoxynivalenol
TL;DR: Deepoxydeoxynivalenol (CAS 88054-24-4) is a chemical compound with molecular formula C15H20O5 and molecular weight 280.13107 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1S,2R,3S,7R,9S,10R)-3,10-dihydroxy-2-(hydroxymethyl)-1,5-dimethyl-12-methylidene-8-oxatricyclo[7.2.1.02,7]dodec-5-en-4-one
Also Known As: Deepoxy-deoxynivalenol, De-epoxy-deoxynivalenol, DEEPOXYDEOXYNIVALENOL, Deepoxydeoxynivaleno, DOM-I
Technical Specifications
| Molecular Formula | C15H20O5 |
| Molecular Weight | 280.13107 g/mol |
| XLogP | 0.0 |
| Topological Polar Surface Area (TPSA) | 87.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 280.13107 Da |
| Heavy Atoms | 20 |
| Complexity | 524.0 |
| SMILES | CC1=C[C@@H]2[C@]([C@@H](C1=O)O)([C@]3(C[C@H]([C@H](C3=C)O2)O)C)CO |
| InChIKey | ZACLXWTWERGCLX-MDUHGFIHSA-N |
Chemical Property Profile of Deepoxydeoxynivalenol
Property Insights of Deepoxydeoxynivalenol
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Deepoxydeoxynivalenol. The TPSA of 87.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Deepoxydeoxynivalenol. Following Lipinski's Rule of Five, Deepoxydeoxynivalenol has 3 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 Deepoxydeoxynivalenol?
The CAS number of Deepoxydeoxynivalenol is 88054-24-4.
What is the molecular formula of Deepoxydeoxynivalenol?
The molecular formula of Deepoxydeoxynivalenol is C15H20O5.
What is the molecular weight of Deepoxydeoxynivalenol?
The molecular weight of Deepoxydeoxynivalenol is 280.13107 g/mol.
Where can I buy Deepoxydeoxynivalenol?
You can request a quote for Deepoxydeoxynivalenol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Deepoxydeoxynivalenol?
Yes, CoreyChem provides custom synthesis services for Deepoxydeoxynivalenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.