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CHEBI:228923 - (-)-Isochaminic acid

ChEBI IDCHEBI:228923
ChEBI Name(-)-Isochaminic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC10H14O2
Net Charge0
Average Mass166.220
Monoisotopic Mass166.09938
SMILES[H][C@@]12CCC(C(=O)O)=C[C@]1([H])C2(C)C
InChIInChI=1S/C10H14O2/c1-10(2)7-4-3-6(9(11)12)5-8(7)10/h5,7-8H,3-4H2,1-2H3,(H,11,12)/t7-,8+/m1/s1
InChIKeyBKLAIYZBALVMQV-SFYZADRCSA-N
Species of MetaboliteComponentSourceComments
Zea mays (ncbitaxon:4577) exometabolome MetaboLights (MTBLS8903)
ChEBI Ontology
Outgoing Relation(s)
(-)-Isochaminic acid (CHEBI:228923) is a monoterpenoid (CHEBI:25409)
IUPAC Name 
(1S,6R)-7,7-dimethylbicyclo[4.1.0]hept-2-ene-3-carboxylic acid
Manual XrefsDatabases
555055ChemSpider