Chemical Compound

8-Propanoylneosolaniol

CAS Registry Number 111112-47-1
8-Propanoylneosolaniol chemical structure
Primary Record

8-Propanoylneosolaniol

In stock
3,118 g
Purity
99.3 %
CAS
111112-47-1

Compound Identifiers & Properties

CAS
111112-47-1
PubChem CID
183169
SMILES
CCC(=O)O[C@H]1C[C@]2([C@@H](C=C1C)O[C@@H]3[C@@H]([C@H]([C@]2([C@]34CO4)C)OC(=O)C)O)COC(=O)C
Canonical SMILES
CCC(=O)O[C@H]1C[C@@]2(COC(C)=O)[C@@H](C=C1C)O[C@@H]1[C@H](O)[C@@H](OC(C)=O)[C@@]2(C)[C@]12CO2

Names & Synonyms

  • 8-Propanoylneosolaniol
  • 8-propionylneosolaniol
  • Neosolaniol 8-propionate
  • CHEMBL422681
  • DTXSID90912002
  • CHEBI:180728
  • CID183169
  • CID 183169
  • 111112-47-1
  • 4,15-Bis(acetyloxy)-3-hydroxy-12,13-epoxytrichothec-9-en-8-yl propanoate
  • 4beta,15-Bis(acetyloxy)-3alpha-hydroxy-12,13-epoxytrichothec-9-en-8alpha-yl propanoate
  • [(1S,2R,4S,7R,9R,10R,11S,12S)-11-acetyloxy-2-(acetyloxymethyl)-10-hydroxy-1,5-dimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-4-yl] propanoate
  • Trichothec-9-ene-3,4,8,15-tetrol, 12,13-epoxy-, 4,15-diacetate 8-propanoate, (3alpha,4beta,8alpha)-