EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:221001 - 2'3'-dihydrosorbicillin

ChEBI IDCHEBI:221001
ChEBI Name2'3'-dihydrosorbicillin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H18O3
Net Charge0
Average Mass234.295
Monoisotopic Mass234.12559
SMILESC/C=C/CCC(=O)c1cc(C)c(O)c(C)c1O
InChIInChI=1S/C14H18O3/c1-4-5-6-7-12(15)11-8-9(2)13(16)10(3)14(11)17/h4-5,8,16-17H,6-7H2,1-3H3/b5-4+
InChIKeyQQBOFNUXGPKLIK-SNAWJCMRSA-N
Species of MetaboliteComponentSourceComments
Verticillium (ncbitaxon:1036719) - DOI (10.1016/S0040-4020(01)88647-6)
ChEBI Ontology
Outgoing Relation(s)
2'3'-dihydrosorbicillin (CHEBI:221001) is a aromatic ketone (CHEBI:76224)
IUPAC Name 
(E)-1-(2,4-dihydroxy-3,5-dimethylphenyl)hex-4-en-1-one
Manual XrefsDatabases
10289827ChemSpider