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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-methylpentanal
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Accession:CHEBI:17998 term browser browse the term
Definition:An alpha-CH2-containing aldehyde that has formula C6H12O.
Synonyms:related_synonym: 4-Methyl valeraldehyde;   Formula=C6H12O;   InChI=1S/C6H12O/c1-6(2)4-3-5-7/h5-6H,3-4H2,1-2H3;   InChIKey=JGEGJYXHCFUMJF-UHFFFAOYSA-N;   Isocaproaldehyde;   Isohexanal;   SMILES=C(C(C)C)CC=O
 alt_id: CHEBI:12028;   CHEBI:1901;   CHEBI:20449;   CHEBI:44083
 xref: CAS:1119-16-0;   KEGG:C02373
 xref_mesh: MESH:C018575

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Term Annotations click to browse term
  CHEBI ontology 2
    role 2
      application 2
        solvent 1
          formic acid 0
            formyl group 0
              aldehyde 0
                alpha-CH2-containing aldehyde 0
                  4-methylpentanal 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 2
    subatomic particle 2
      composite particle 2
        hadron 2
          baryon 2
            nucleon 2
              atomic nucleus 2
                atom 2
                  main group element atom 2
                    p-block element atom 2
                      carbon group element atom 2
                        carbon atom 2
                          organic molecular entity 2
                            heteroorganic entity 2
                              organochalcogen compound 1
                                organooxygen compound 0
                                  carbon oxoacid 0
                                    carboxylic acid 0
                                      carboacyl group 0
                                        univalent carboacyl group 0
                                          formyl group 0
                                            aldehyde 0
                                              alpha-CH2-containing aldehyde 0
                                                4-methylpentanal 0
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