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CHEBI:174652 - (E,E)-Boviquinone 3

ChEBI IDCHEBI:174652
ChEBI Name(E,E)-Boviquinone 3
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SubmitterMetaboLights
DownloadsMolfile
FormulaC21H28O4
Net Charge0
Average Mass344.451
Monoisotopic Mass344.19876
SMILESCC(C)=CCC/C(C)=C/CC/C(C)=C/CC1=C(O)C(=O)C=C(O)C1=O
InChIInChI=1S/C21H28O4/c1-14(2)7-5-8-15(3)9-6-10-16(4)11-12-17-20(24)18(22)13-19(23)21(17)25/h7,9,11,13,22,25H,5-6,8,10,12H2,1-4H3/b15-9+,16-11+
InChIKeyADRVEZVEKSCRHP-XGGJEREUSA-N
ChEBI Ontology
Outgoing Relation(s)
(E,E)-Boviquinone 3 (CHEBI:174652) is a diterpenoid (CHEBI:23849)
IUPAC Name 
2,5-dihydroxy-3-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]cyclohexa-2,5-diene-1,4-dione
Manual XrefsDatabases
30776848ChemSpider
HMDB0030743HMDB