Chemical Compound

Neosolaniol 8-butyrate

CAS Registry Number 98813-18-4
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Neosolaniol 8-butyrate chemical structure
Primary Record

Neosolaniol 8-butyrate

In stock
9,241 g
Purity
98.7 %
CAS
98813-18-4

Compound Identifiers & Properties

CAS
98813-18-4
PubChem CID
13797598
SMILES
CCCC(=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
CCCC(=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

  • Neosolaniol 8-butyrate
  • 8-Butanoylneosolaniol
  • I2RCY0K6FQ
  • UNII-I2RCY0K6FQ
  • RefChem:202271
  • CHEMBL356196
  • CHEBI:168626
  • 98813-18-4
  • Trichothec-9-ene-3,4,8,15-tetrol, 12,13-epoxy-, 4,15-diacetate 8-butanoate, (3alpha,4beta,8alpha)-
  • [(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] butanoate
  • TRICHOTHEC-9-ENE-3,4,8,15-TETROL, 12,13-EPOXY-, 4,15-DIACETATE 8-BUTANOATE, (3.ALPHA.,4.BETA.,8.ALPHA.)-