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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:4-heptanone
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Accession:CHEBI:89484 term browser browse the term
Definition:A dialkyl ketone that is heptane in which the two methylene protons at position 4 have been replaced by an oxo group.
Synonyms:related_synonym: 4-Oxoheptane;   Butyrone;   Di-n-propyl ketone;   Dipropyl ketone;   Formula=C7H14O;   InChI=1S/C7H14O/c1-3-5-7(8)6-4-2/h3-6H2,1-2H3;   InChIKey=HCFAJYNVAYBARA-UHFFFAOYSA-N;   Propyl ketone;   SMILES=O=C(CCC)CCC;   heptan-4-one
 xref: AGR:IND80034656;   CAS:123-19-3;   HMDB:HMDB0004814;   KNApSAcK:C00035501;   PMID:11282094;   PMID:15195467;   PMID:15280519;   PMID:18803420;   PMID:24591313;   PMID:25818559;   PMID:26055441;   PMID:27060700;   PMID:27236897;   PMID:27241792;   PMID:27347408;   PMID:27779841;   PMID:27997626;   PMID:28254044;   PMID:28633145;   PMID:6853657;   Reaxys:1699049;   Wikipedia:4-Heptanone


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Term Annotations click to browse term
  CHEBI ontology 19811
    role 19818
      application 19630
        indicator 8759
          biomarker 6568
            4-heptanone 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19811
    subatomic particle 19809
      composite particle 19809
        hadron 19840
          baryon 19809
            nucleon 19809
              atomic nucleus 19809
                atom 19809
                  main group element atom 19759
                    p-block element atom 19759
                      carbon group element atom 19708
                        carbon atom 19734
                          organic molecular entity 19705
                            heteroorganic entity 19459
                              organochalcogen compound 19222
                                organooxygen compound 19137
                                  carbonyl compound 18858
                                    ketone 17163
                                      dialkyl ketone 51
                                        4-heptanone 0
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