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CHEBI:189371 - (2E)-2-(hydroxymethyl)-3-[3-oxo-5-(propan-2-yl)-1,3,4,5,6,7-hexahydro-2-benzofuran-4-yl]prop-2-enoic acid

ChEBI IDCHEBI:189371
ChEBI Name(2E)-2-(hydroxymethyl)-3-[3-oxo-5-(propan-2-yl)-1,3,4,5,6,7-hexahydro-2-benzofuran-4-yl]prop-2-enoic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H20O5
Net Charge0
Average Mass280.320
Monoisotopic Mass280.13107
SMILESCC(C)C1CCC2=C(C(=O)OC2)C1/C=C(\CO)C(=O)O
InChIInChI=1S/C15H20O5/c1-8(2)11-4-3-9-7-20-15(19)13(9)12(11)5-10(6-16)14(17)18/h5,8,11-12,16H,3-4,6-7H2,1-2H3,(H,17,18)/b10-5+
InChIKeyYWASZTJGPFRWMW-BJMVGYQFSA-N
Species of MetaboliteComponentSourceComments
Arabidopsis thaliana (ncbitaxon:3702) leaf (BTO:0000713) MetaboLights (MTBLS3997)
ChEBI Ontology
Outgoing Relation(s)
(2E)-2-(hydroxymethyl)-3-[3-oxo-5-(propan-2-yl)-1,3,4,5,6,7-hexahydro-2-benzofuran-4-yl]prop-2-enoic acid (CHEBI:189371) is a terpene lactone (CHEBI:37668)
IUPAC Name 
(E)-2-(hydroxymethyl)-3-(3-oxo-5-propan-2-yl-4,5,6,7-tetrahydro-1H-2-benzouran-4-yl)prop-2-enoic acid
Manual XrefsDatabases
22943150ChemSpider