Trichothec-8-en-7-one, 3,8,15-tris(acetyloxy)-12,13-epoxy-, (3alpha)-
[(1R,2S,7R,9R,10R)-4,10-diacetyloxy-1,5-dimethyl-3-oxospiro[8-oxatricyclo[7.2.1.02,7]dodec-4-ene-12,2'-oxirane]-2-yl]methyl acetate
Also Known As: Trichothec-8-en-7-one, 3,8,15-tris(acetyloxy)-12,13-epoxy-, (3alpha)-|7-Oxo-12,13-epoxytrichothec-8-ene-3,8,15-triyl triacetate|(12xi)-7-Oxo-3alpha-12,13-epoxytrichothec-8-ene-3,8,15-triyl triacetate
| Molecular Formula | C21H26O9 |
|---|---|
| Molecular Weight | 422.15768 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 118.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 422.15768 |
| Monoisotopic Mass | 422.15768 |
| Heavy Atoms | 30 |
| Complexity | 876.0 |
Chemical Identifiers
| CAS Number | 92397-71-2 |
|---|---|
| SMILES | CC1=C(C(=O)[C@]2([C@@H](C1)O[C@@H]3[C@@H](C[C@]2(C34CO4)C)OC(=O)C)COC(=O)C)OC(=O)C |
| InChIKey | SPPYZUFYUICUCL-FSWPFWDFSA-N |
Product Overview
Trichothec-8-en-7-one, 3,8,15-tris(acetyloxy)-12,13-epoxy-, (3alpha)- (CAS 92397-71-2), with molecular formula C21H26O9 and molecular weight 422.15768 g/mol. IUPAC: [(1R,2S,7R,9R,10R)-4,10-diacetyloxy-1,5-dimethyl-3-oxospiro[8-oxatricyclo[7.2.1.02,7]dodec-4-ene-12,2'-oxirane]-2-yl]methyl acetate.
Trichothec-8-en-7-one, 3,8,15-tris(acetyloxy)-12,13-epoxy-, (3alpha)- is a custom synthesis product. We offer services from milligram to kilogram scale.
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