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CHEBI ONTOLOGY - ANNOTATIONS

The Chemical Entities of Biological Interest (ChEBI) ontology is downloaded weekly from EMBL-EBI at http://www.ebi.ac.uk/chebi/. The data is made available under the Creative Commons License (CC BY 3.0, http://creativecommons.org/licenses/by/3.0/). For more information see: Degtyarenko et al. (2008) ChEBI: a database and ontology for chemical entities of biological interest. Nucleic Acids Res. 36, D344–D350.

Term:3-methylisoeugenol
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Accession:CHEBI:59083 term browser browse the term
Definition:An isoeugenol derivative carrying a 3-methyl substituent.
Synonyms:exact_synonym: 2-methoxy-3-methyl-4-(1-prop-1-en-1-yl)phenol
 related_synonym: 2-methoxy-3-methyl-4-(prop-1-enyl)phenol;   3-methyl isoeugenol;   Formula=C11H14O2;   InChI=1S/C11H14O2/c1-4-5-9-6-7-10(12)11(13-3)8(9)2/h4-7,12H,1-3H3;   InChIKey=HHZIHDLTDXMWGF-UHFFFAOYSA-N;   SMILES=COc1c(O)ccc(C=CC)c1C
 xref: PMID:9084914;   Reaxys:25496323


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Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19792
    role 19738
      biological role 19737
        aetiopathogenetic role 18869
          sensitiser 9734
            isoeugenol 60
              3-methylisoeugenol 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19792
    subatomic particle 19788
      composite particle 19788
        hadron 19788
          baryon 19788
            nucleon 19788
              atomic nucleus 19788
                atom 19788
                  main group element atom 19675
                    p-block element atom 19675
                      carbon group element atom 19571
                        carbon atom 19560
                          organic molecular entity 19560
                            organic molecule 19483
                              organic cyclic compound 19252
                                carbocyclic compound 17645
                                  benzenoid aromatic compound 17198
                                    benzenes 16941
                                      methoxybenzenes 1834
                                        monomethoxybenzene 1740
                                          guaiacols 1356
                                            guaiacol 1309
                                              isoeugenol 60
                                                3-methylisoeugenol 0
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