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CHEBI:181193 - (3Ar,6R,7aR)-6-methyl-3-methylidene-6-(4-oxopentyl)-3a,4,7,7a-tetrahydro-1-benzofuran-2,5-dione

ChEBI IDCHEBI:181193
ChEBI Name(3Ar,6R,7aR)-6-methyl-3-methylidene-6-(4-oxopentyl)-3a,4,7,7a-tetrahydro-1-benzofuran-2,5-dione
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H20O4
Net Charge0
Average Mass264.321
Monoisotopic Mass264.13616
SMILES[H][C@@]12C[C@@](C)(CCCC(C)=O)C(=O)C[C@]1([H])C(=C)C(=O)O2
InChIInChI=1S/C15H20O4/c1-9(16)5-4-6-15(3)8-12-11(7-13(15)17)10(2)14(18)19-12/h11-12H,2,4-8H2,1,3H3/t11-,12-,15-/m1/s1
InChIKeyMIRSLSRVCIOISZ-LALPHHSUSA-N
ChEBI Ontology
Outgoing Relation(s)
(3Ar,6R,7aR)-6-methyl-3-methylidene-6-(4-oxopentyl)-3a,4,7,7a-tetrahydro-1-benzofuran-2,5-dione (CHEBI:181193) is a benzofurans (CHEBI:35259)
IUPAC Name 
(3aR,6R,7aR)-6-methyl-3-methylidene-6-(4-oxopentyl)-3a,4,7,7a-tetrahydro-1-benzouran-2,5-dione
Manual XrefsDatabases
10312451ChemSpider