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CHEBI:174958 - 5-Ethoxysorgoleone 358

ChEBI IDCHEBI:174958
ChEBI Name5-Ethoxysorgoleone 358
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SubmitterMetaboLights
DownloadsMolfile
FormulaC23H32O4
Net Charge0
Average Mass372.505
Monoisotopic Mass372.23006
SMILESC=CC/C=C/C/C=C/CCCCCCCC1=C(O)C(=O)C=C(OCC)C1=O
InChIInChI=1S/C23H32O4/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-19-22(25)20(24)18-21(23(19)26)27-4-2/h3,6-7,9-10,18,25H,1,4-5,8,11-17H2,2H3/b7-6+,10-9+
InChIKeyTZHMUUDTNYTFMW-AVQMFFATSA-N
ChEBI Ontology
Outgoing Relation(s)
5-Ethoxysorgoleone 358 (CHEBI:174958) is a p-quinones (CHEBI:25830)
5-Ethoxysorgoleone 358 (CHEBI:174958) is a benzoquinones (CHEBI:22729)
IUPAC Name 
5-ethoxy-2-hydroxy-3-[(8E,11E)-pentadeca-8,11,14-trienyl]cyclohexa-2,5-diene-1,4-dione
Manual XrefsDatabases
30776951ChemSpider
HMDB0032784HMDB