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CHEBI:4478 - Diacetoxyscirpenol

ChEBI IDCHEBI:4478
ChEBI NameDiacetoxyscirpenol
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC19H26O7
Net Charge0
Average Mass366.410
Monoisotopic Mass366.16785
SMILES[H][C@@]12C=C(C)CC[C@]1(COC(C)=O)[C@@]1(C)[C@H](OC(C)=O)[C@@H](O)[C@@]([H])(O2)[C@]12CO2
InChIInChI=1S/C19H26O7/c1-10-5-6-18(8-23-11(2)20)13(7-10)26-16-14(22)15(25-12(3)21)17(18,4)19(16)9-24-19/h7,13-16,22H,5-6,8-9H2,1-4H3/t13-,14-,15-,16-,17-,18-,19-/m1/s1
InChIKeyAUGQEEXBDZWUJY-ZLJUKNTDSA-N
Roles Classification
Biological Role:
mycotoxin  Poisonous substance produced by fungi.
ChEBI Ontology
Outgoing Relation(s)
Diacetoxyscirpenol (CHEBI:4478) is a trichothecene (CHEBI:55517)
Synonym  Source
DiacetoxyscirpenolKEGG COMPOUND
Manual XrefsDatabases
C09662KEGG COMPOUND
C00003129KNApSAcK
Registry NumbersSources
CAS:2270-40-8KEGG COMPOUND