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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:isopyridoxal
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Accession:CHEBI:17889 term browser browse the term
Definition:A pyridinecarbaldehyde that is pyridine-5-carbaldehyde bearing methyl, hydroxy and hydroxymethyl substituents at positions 2, 3 and 4 respectively.
Synonyms:exact_synonym: 5-hydroxy-4-(hydroxymethyl)-6-methylpyridine-3-carbaldehyde
 related_synonym: Formula=C8H9NO3;   InChI=1S/C8H9NO3/c1-5-8(12)7(4-11)6(3-10)2-9-5/h2-3,11-12H,4H2,1H3;   InChIKey=GNKXHPULSPWUAK-UHFFFAOYSA-N;   SMILES=Cc1ncc(C=O)c(CO)c1O
 alt_id: CHEBI:14477;   CHEBI:24919;   CHEBI:6050
 xref: CAS:66-72-8;   HMDB:HMDB0004290;   KEGG:C06051
 xref_mesh: MESH:D011730
 xref: MetaCyc:CPD-383;   PMID:13702476;   PMID:22770225;   PMID:5769992;   Reaxys:383768


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Path 1
Term Annotations click to browse term
  CHEBI ontology 19812
    role 19761
      biological role 19761
        biochemical role 19381
          metabolite 19356
            isopyridoxal 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19812
    subatomic particle 19811
      composite particle 19811
        hadron 19811
          baryon 19811
            nucleon 19811
              atomic nucleus 19811
                atom 19811
                  main group element atom 19708
                    p-block element atom 19708
                      carbon group element atom 19630
                        carbon atom 19620
                          organic molecular entity 19620
                            organic group 18728
                              organic divalent group 18719
                                organodiyl group 18719
                                  carbonyl group 18667
                                    carbonyl compound 18667
                                      carboxylic acid 18364
                                        carboacyl group 17482
                                          univalent carboacyl group 17482
                                            formyl group 8786
                                              aldehyde 8786
                                                heteroarenecarbaldehyde 20
                                                  pyridinecarbaldehyde 20
                                                    isopyridoxal 0
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