{"compound":"ZBetaOcimene","smiles":"CC(=CC/C=C(/C)\\C=C)C","inchikey":"IHPKGUQCSIINRJ-NTMALXAHSA-N","pathway":"Terpenoids","superclass":"Monoterpenoids","class":"Acyclic monoterpenoids"}
{"compound":"EBetaOcimene","smiles":"CC(=CC/C=C(\\C)/C=C)C","inchikey":"IHPKGUQCSIINRJ-CSKARUKUSA-N","pathway":"Terpenoids","superclass":"Monoterpenoids","class":"Acyclic monoterpenoids"}
{"compound":"Benzaldehyde","smiles":"C1=CC=C(C=C1)C=O","inchikey":"HUMNYLRZRPPJDN-UHFFFAOYSA-N","pathway":"Shikimates and Phenylpropanoids"}
{"compound":"MethylBenzoate","smiles":"COC(=O)C1=CC=CC=C1","inchikey":"QPJVMBTYPHYUOC-UHFFFAOYSA-N","pathway":"Shikimates and Phenylpropanoids","superclass":"Phenolic acids (C6-C1)","class":"Simple phenolic acids"}
{"compound":"Phenylacetaldehyde","smiles":"C1=CC=C(C=C1)CC=O","inchikey":"DTUQWGWMVIHBKE-UHFFFAOYSA-N","pathway":"Shikimates and Phenylpropanoids","superclass":"Phenylpropanoids (C6-C3)","class":"Cinnamic acids and derivatives"}
{"compound":"Acetophenone","smiles":"CC(=O)C1=CC=CC=C1","inchikey":"KWOLFJPFCHCOCG-UHFFFAOYSA-N","pathway":"Shikimates and Phenylpropanoids"}
{"compound":"FourOxoisophorone","smiles":"CC1=CC(=O)CC(C1=O)(C)C","inchikey":"AYJXHIDNNLJQDT-UHFFFAOYSA-N","pathway":"Terpenoids","superclass":"Apocarotenoids","class":"Apocarotenoids(epsilon-)"}
{"compound":"BenzylAcetate","smiles":"CC(=O)OCC1=CC=CC=C1","inchikey":"QUKGYYKBILRGFE-UHFFFAOYSA-N","pathway":"Shikimates and Phenylpropanoids","superclass":"Phenylpropanoids (C6-C3)","class":"Cinnamic acids and derivatives"}
{"compound":"MethylPhenylacetate","smiles":"COC(=O)CC1=CC=CC=C1","inchikey":"CRZQGDNQQAALAY-UHFFFAOYSA-N","pathway":"Shikimates and Phenylpropanoids"}
{"compound":"MethylSalicylate","smiles":"COC(=O)C1=CC=CC=C1O","inchikey":"OSWPMRLSEDHDFF-UHFFFAOYSA-N","pathway":"Shikimates and Phenylpropanoids","superclass":"Phenolic acids (C6-C1)","class":"Simple phenolic acids"}
{"compound":"PhenylethylAcetate","smiles":"CC(=O)OCCC1=CC=CC=C1","inchikey":"MDHYEMXUFSJLGV-UHFFFAOYSA-N","pathway":"Shikimates and Phenylpropanoids"}
{"compound":"BenzylAlcohol","smiles":"C1=CC=C(C=C1)CO","inchikey":"WVDDGKGOMKODPV-UHFFFAOYSA-N","pathway":"Shikimates and Phenylpropanoids"}
{"compound":"PhenylethylAlcohol","smiles":"C1=CC=C(C=C1)CCO","inchikey":"WRMNZCZEMHIOCP-UHFFFAOYSA-N","pathway":"Shikimates and Phenylpropanoids","superclass":"Phenylethanoids (C6-C2)","class":"Phenylethanoids"}
{"compound":"FourMethoxybenzaldehyde","smiles":"COC1=CC=C(C=C1)C=O","inchikey":"ZRSNZINYAWTAHE-UHFFFAOYSA-N","pathway":"Shikimates and Phenylpropanoids","superclass":"Phenolic acids (C6-C1)","class":"Simple phenolic acids"}
{"compound":"BenzylBenzoate","smiles":"C1=CC=C(C=C1)COC(=O)C2=CC=CC=C2","inchikey":"SESFRYSPDFLNCH-UHFFFAOYSA-N","pathway":"Shikimates and Phenylpropanoids","superclass":"Phenolic acids (C6-C1)","class":"Simple phenolic acids"}