Trichothec-9-ene-3,4,8,15-tetrol, 12,13-epoxy-, (3|A,4|A,8|A)-
TL;DR: Trichothec-9-ene-3,4,8,15-tetrol, 12,13-epoxy-, (3|A,4|A,8|A)- (CAS 34114-99-3) is a chemical compound with molecular formula C15H22O6 and molecular weight 298.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,4S,7R,9R,10R,11S)-2-(hydroxymethyl)-1,5-dimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-4,10,11-triol
Also Known As: T-2 Tetraol, T-?2 Tetraol, Trichothec-9-ene-3,4,8,15-tetrol, 12,13-epoxy-, (3alpha,4beta,8alpha)-, Trichothec-9-ene-3,4,8,15-tetrol, 12,13-epoxy-, (3, A,4
| Molecular Formula | C15H22O6 |
|---|---|
| Molecular Weight | 298.14 g/mol |
| LogP | -2.1 |
| Topological Polar Surface Area | 103.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 298.14163 |
| Heavy Atoms | 21 |
| Complexity | 520.0 |
Chemical Identifiers
| CAS Number | 34114-99-3 |
|---|---|
| SMILES | CC1=C[C@@H]2[C@](C[C@@H]1O)(C3([C@@H]([C@H]([C@H](C34CO4)O2)O)O)C)CO |
| InChIKey | ZAXZBJSXSOISTF-VREARNNESA-N |
Product Overview
Trichothec-9-ene-3,4,8,15-tetrol, 12,13-epoxy-, (3|A,4|A,8|A)- (CAS 34114-99-3), with molecular formula C15H22O6 and molecular weight 298.14 g/mol. IUPAC: (2R,4S,7R,9R,10R,11S)-2-(hydroxymethyl)-1,5-dimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-4,10,11-triol.
Chemical Property Profile of Trichothec-9-ene-3,4,8,15-tetrol, 12,13-epoxy-, (3|A,4|A,8|A)-
Property Insights of Trichothec-9-ene-3,4,8,15-tetrol, 12,13-epoxy-, (3|A,4|A,8|A)-
The XLogP value of -2.1 indicates that Trichothec-9-ene-3,4,8,15-tetrol, 12,13-epoxy-, (3|A,4|A,8|A)- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Trichothec-9-ene-3,4,8,15-tetrol, 12,13-epoxy-, (3|A,4|A,8|A)-. Following Lipinski's Rule of Five, Trichothec-9-ene-3,4,8,15-tetrol, 12,13-epoxy-, (3|A,4|A,8|A)- has 4 hydrogen bond donor(s) and 6 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 Trichothec-9-ene-3,4,8,15-tetrol, 12,13-epoxy-, (3|A,4|A,8|A)-?
The CAS number of Trichothec-9-ene-3,4,8,15-tetrol, 12,13-epoxy-, (3|A,4|A,8|A)- is 34114-99-3.
What is the molecular formula of Trichothec-9-ene-3,4,8,15-tetrol, 12,13-epoxy-, (3|A,4|A,8|A)-?
The molecular formula of Trichothec-9-ene-3,4,8,15-tetrol, 12,13-epoxy-, (3|A,4|A,8|A)- is C15H22O6.
What is the molecular weight of Trichothec-9-ene-3,4,8,15-tetrol, 12,13-epoxy-, (3|A,4|A,8|A)-?
The molecular weight of Trichothec-9-ene-3,4,8,15-tetrol, 12,13-epoxy-, (3|A,4|A,8|A)- is 298.14 g/mol.
Where can I buy Trichothec-9-ene-3,4,8,15-tetrol, 12,13-epoxy-, (3|A,4|A,8|A)-?
You can request a quote for Trichothec-9-ene-3,4,8,15-tetrol, 12,13-epoxy-, (3|A,4|A,8|A)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Trichothec-9-ene-3,4,8,15-tetrol, 12,13-epoxy-, (3|A,4|A,8|A)-?
Yes, KEHONG BIO provides custom synthesis services for Trichothec-9-ene-3,4,8,15-tetrol, 12,13-epoxy-, (3|A,4|A,8|A)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.