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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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4-methylpentanal term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G Akr1b10 aldo-keto reductase family 1 member B10 increases reduction ISO AKR1B10 protein results in increased reduction of isocaproaldehyde CTD PMID:19013440 NCBI chr 4:61,813,265...61,830,371
Ensembl chr 4:61,771,970...61,828,657
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Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19771
    role 19716
      application 19406
        solvent 16547
          formic acid 8821
            formyl group 8794
              aldehyde 8794
                alpha-CH2-containing aldehyde 1748
                  4-methylpentanal 1
Path 2
Term Annotations click to browse term
  CHEBI ontology 19771
    subatomic particle 19770
      composite particle 19770
        hadron 19770
          baryon 19770
            nucleon 19770
              atomic nucleus 19770
                atom 19770
                  main group element atom 19658
                    p-block element atom 19658
                      carbon group element atom 19574
                        carbon atom 19564
                          organic molecular entity 19564
                            organic group 18599
                              organic divalent group 18590
                                organodiyl group 18590
                                  carbonyl group 18505
                                    carbonyl compound 18505
                                      carboxylic acid 18157
                                        carboacyl group 17416
                                          univalent carboacyl group 17416
                                            formyl group 8794
                                              aldehyde 8794
                                                alpha-CH2-containing aldehyde 1748
                                                  4-methylpentanal 1
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