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CHEBI:189122 - exo-1,7,7-Trimethylbicyclo(2.2.1)hept-2-yl acrylate

ChEBI IDCHEBI:189122
ChEBI Nameexo-1,7,7-Trimethylbicyclo(2.2.1)hept-2-yl acrylate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H20O2
Net Charge0
Average Mass208.301
Monoisotopic Mass208.14633
SMILES[H][C@]12CC[C@](C)(C(OC(=O)C=C)C1)C2(C)C
InChIInChI=1S/C13H20O2/c1-5-11(14)15-10-8-9-6-7-13(10,4)12(9,2)3/h5,9-10H,1,6-8H2,2-4H3/t9-,10?,13+/m0/s1
InChIKeyPSGCQDPCAWOCSH-BOURZNODSA-N
Species of MetaboliteComponentSourceComments
Arabidopsis thaliana (ncbitaxon:3702) leaf (BTO:0000713) MetaboLights (MTBLS3997)
ChEBI Ontology
Outgoing Relation(s)
exo-1,7,7-Trimethylbicyclo(2.2.1)hept-2-yl acrylate (CHEBI:189122) is a monoterpenoid (CHEBI:25409)
IUPAC Name 
[(1S,4S)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl] prop-2-enoate
Manual XrefsDatabases
83966ChemSpider