EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:82240 - Dinoseb acetate

ChEBI IDCHEBI:82240
ChEBI NameDinoseb acetate
Stars
DownloadsMolfile
FormulaC12H14N2O6
Net Charge0
Average Mass282.252
Monoisotopic Mass282.08519
SMILESCCC(C)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1OC(C)=O
InChIInChI=1S/C12H14N2O6/c1-4-7(2)10-5-9(13(16)17)6-11(14(18)19)12(10)20-8(3)15/h5-7H,4H2,1-3H3
InChIKeyRDJTWDKSYLLHRW-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Dinoseb acetate (CHEBI:82240) is a benzoate ester (CHEBI:36054)
Dinoseb acetate (CHEBI:82240) is a phenols (CHEBI:33853)
Manual XrefsDatabases
C19119KEGG COMPOUND
2762PPDB
HMDB0032560HMDB
Registry NumbersSources
CAS:2813-95-8KEGG COMPOUND