4'-Hydroxy T-2 toxin
TL;DR: 4'-Hydroxy T-2 toxin (CAS 112765-59-0) is a chemical compound with molecular formula C24H34O10 and molecular weight 482.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1S,2R,4S,7R,9R,10R,11S)-11-acetyloxy-2-(acetyloxymethyl)-10-hydroxy-1,5-dimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-4-yl] 4-hydroxy-3-methylbutanoate
Also Known As: 4'-Hydroxy T-2 toxin, 4,15-Bis(acetyloxy)-3-hydroxy-12,13-epoxytrichothec-9-en-8-yl 4-hydroxy-3-methylbutanoate, (12xi)-4beta,15-Bis(acetyloxy)-3alpha-hydroxy-12,13-epoxytrichothec-9-en-8alpha-yl 4-hydroxy-3-methylbutanoate, [(1S,2R,4S,7R,9R,10R,11S)-11-Acetyloxy-2-(acetyloxymethyl)-10-hydroxy-1,5-dimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-4-yl] 4-hydroxy-3-methylbutanoate
| Molecular Formula | C24H34O10 |
|---|---|
| Molecular Weight | 482.22 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 141.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 10 |
| Exact Mass | 482.2152 |
| Heavy Atoms | 34 |
| Complexity | 900.0 |
Chemical Identifiers
| CAS Number | 112765-59-0 |
|---|---|
| SMILES | CC1=C[C@@H]2[C@](C[C@@H]1OC(=O)CC(C)CO)([C@]3([C@@H]([C@H]([C@H](C34CO4)O2)O)OC(=O)C)C)COC(=O)C |
| InChIKey | LAXBEQNJAHUVIT-XJIZHKRUSA-N |
Product Overview
4'-Hydroxy T-2 toxin (CAS 112765-59-0), with molecular formula C24H34O10 and molecular weight 482.22 g/mol. IUPAC: [(1S,2R,4S,7R,9R,10R,11S)-11-acetyloxy-2-(acetyloxymethyl)-10-hydroxy-1,5-dimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-4-yl] 4-hydroxy-3-methylbutanoate.
Chemical Property Profile of 4'-Hydroxy T-2 toxin
Property Insights of 4'-Hydroxy T-2 toxin
The XLogP value of -0.3 indicates that 4'-Hydroxy T-2 toxin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 141.0 Ų indicates high polarity, suggesting 4'-Hydroxy T-2 toxin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4'-Hydroxy T-2 toxin has 2 hydrogen bond donor(s) and 10 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 4'-Hydroxy T-2 toxin?
The CAS number of 4'-Hydroxy T-2 toxin is 112765-59-0.
What is the molecular formula of 4'-Hydroxy T-2 toxin?
The molecular formula of 4'-Hydroxy T-2 toxin is C24H34O10.
What is the molecular weight of 4'-Hydroxy T-2 toxin?
The molecular weight of 4'-Hydroxy T-2 toxin is 482.22 g/mol.
Where can I buy 4'-Hydroxy T-2 toxin?
You can request a quote for 4'-Hydroxy T-2 toxin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4'-Hydroxy T-2 toxin?
Yes, KEHONG BIO provides custom synthesis services for 4'-Hydroxy T-2 toxin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.