EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:216405 - Cytosporone F

ChEBI IDCHEBI:216405
ChEBI NameCytosporone F
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H22O5
Net Charge0
Average Mass318.369
Monoisotopic Mass318.14672
SMILESCCC/C=C/C=C/C(=O)c1c(O)cc(O)cc1CC(=O)OCC
InChIInChI=1S/C18H22O5/c1-3-5-6-7-8-9-15(20)18-13(11-17(22)23-4-2)10-14(19)12-16(18)21/h6-10,12,19,21H,3-5,11H2,1-2H3/b7-6+,9-8+
InChIKeyKQWFRRUUTPESMK-BLHCBFLLSA-N
Species of MetaboliteComponentSourceComments
Neophaeosphaeria quadriseptata (ncbitaxon:125377) - PubMed (18052326)
ChEBI Ontology
Outgoing Relation(s)
Cytosporone F (CHEBI:216405) is a resorcinols (CHEBI:33572)
IUPAC Name 
ethyl 2-[3,5-dihydroxy-2-[(2E,4E)-octa-2,4-dienoyl]phenyl]acetate
Manual XrefsDatabases
78435976ChemSpider