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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:3,4,5-Trimethoxyphenyl-2-propanone
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Accession:CHEBI:167436 term browser browse the term
Synonyms:exact_synonym: 1-(3,4,5-trimethoxyphenyl)propan-2-one
 related_synonym: Formula=C12H16O4;   InChI=1S/C12H16O4/c1-8(13)5-9-6-10(14-2)12(16-4)11(7-9)15-3/h6-7H,5H2,1-4H3;   InChIKey=WDNDMVGQGRDIBC-UHFFFAOYSA-N;   SMILES=O(C1=CC(CC(=O)C)=CC(OC)=C1OC)C
 xref: CAS:16603-18-2;   Chemspider:154749


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Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 5066
    role 5030
      chemical role 829
        environmental contaminant 201
          benzene 80
            alkylbenzene 80
              3,4,5-Trimethoxyphenyl-2-propanone 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 5066
    subatomic particle 5057
      composite particle 5057
        hadron 5057
          baryon 5057
            nucleon 5057
              atomic nucleus 5057
                atom 5057
                  main group element atom 5026
                    main group molecular entity 5025
                      s-block molecular entity 4957
                        hydrogen molecular entity 4950
                          hydrides 4555
                            organic hydride 4399
                              organic fundamental parent 4399
                                hydrocarbon 4359
                                  cyclic hydrocarbon 108
                                    monocyclic hydrocarbon 80
                                      annulene 80
                                        aromatic annulene 80
                                          benzene 80
                                            alkylbenzene 80
                                              3,4,5-Trimethoxyphenyl-2-propanone 0
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