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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:2-amino-4-(3,4,5-trihydroxyphenyl)buta-1,3-diene-1,1,3-tricarbonitrile
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Accession:CHEBI:94636 term browser browse the term
Definition:A benzenetriol that has formula C13H8N4O3.
Synonyms:related_synonym: Formula=C13H8N4O3;   InChI=1S/C13H8N4O3/c14-4-8(12(17)9(5-15)6-16)1-7-2-10(18)13(20)11(19)3-7/h1-3,18-20H,17H2;   InChIKey=JKNOYWVMHPMBEL-UHFFFAOYSA-N;   SMILES=C1=C(C=C(C(=C1O)O)O)C=C(C#N)C(=C(C#N)C#N)N
 xref: LINCS:LSM-5591


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Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19853
    chemical entity 19853
      molecular entity 19851
        polyatomic entity 19765
          heteroatomic molecular entity 19692
            hydroxides 19123
              organic hydroxy compound 18678
                phenols 18156
                  benzenetriol 2551
                    2-amino-4-(3,4,5-trihydroxyphenyl)buta-1,3-diene-1,1,3-tricarbonitrile 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19853
    subatomic particle 19851
      composite particle 19851
        hadron 19851
          baryon 19851
            nucleon 19851
              atomic nucleus 19851
                atom 19851
                  main group element atom 19744
                    p-block element atom 19744
                      chalcogen 19438
                        oxygen atom 19400
                          oxygen molecular entity 19400
                            hydroxides 19123
                              organic hydroxy compound 18678
                                polyol 7812
                                  triol 5975
                                    benzenetriol 2551
                                      2-amino-4-(3,4,5-trihydroxyphenyl)buta-1,3-diene-1,1,3-tricarbonitrile 0
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