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CHEBI:202334 - Vibralactone J

ChEBI IDCHEBI:202334
ChEBI NameVibralactone J
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SubmitterMetaboLights
DownloadsMolfile
FormulaC12H16O4
Net Charge0
Average Mass224.256
Monoisotopic Mass224.10486
SMILESCC(C)=CC[C@@H](CC1=CC(=O)OC1)C(=O)O
InChIInChI=1S/C12H16O4/c1-8(2)3-4-10(12(14)15)5-9-6-11(13)16-7-9/h3,6,10H,4-5,7H2,1-2H3,(H,14,15)/t10-/m0/s1
InChIKeyXXPVXRYPOYQVHN-JTQLQIEISA-N
Species of MetaboliteComponentSourceComments
Boreostereum vibrans (ncbitaxon:1826779) - PubMed (22296151)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Vibralactone J (CHEBI:202334) is a medium-chain fatty acid (CHEBI:59554)
IUPAC Name 
5-methyl-2-[(5-oxo-2H-uran-3-yl)methyl]hex-4-enoic acid
Manual XrefsDatabases
78435609ChemSpider