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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-trimethoxyacetophenone
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Accession:CHEBI:86547 term browser browse the term
Definition:A member of the class of acetophenones that is acetophenone substituted by methoxy groups at positions 3, 4 and 5 respectively.
Synonyms:exact_synonym: 1-(3,4,5-trimethoxyphenyl)ethan-1-one
 related_synonym: Formula=C11H14O4;   InChI=1S/C11H14O4/c1-7(12)8-5-9(13-2)11(15-4)10(6-8)14-3/h5-6H,1-4H3;   InChIKey=VUGQIIQFXCXZJU-UHFFFAOYSA-N;   SMILES=COc1cc(cc(OC)c1OC)C(C)=O
 xref: CAS:1136-86-3;   Reaxys:1463133

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  CHEBI ontology 0
    role 0
      biological role 0
        xenobiotic 0
          acetophenone 0
            3,4,5-trimethoxyacetophenone 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 0
    subatomic particle 0
      composite particle 0
        hadron 0
          baryon 0
            nucleon 0
              atomic nucleus 0
                atom 0
                  main group element atom 0
                    p-block element atom 0
                      carbon group element atom 0
                        carbon atom 0
                          organic molecular entity 0
                            heteroorganic entity 0
                              organochalcogen compound 0
                                organooxygen compound 0
                                  carbonyl compound 0
                                    ketone 0
                                      methyl ketone 0
                                        acetophenones 0
                                          acetophenone 0
                                            3,4,5-trimethoxyacetophenone 0
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