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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 21552
    chemical entity 21550
      molecular entity 21534
        polyatomic entity 21410
          heteroatomic molecular entity 21336
            hydroxides 20130
              organic hydroxy compound 19164
                phenols 18461
                  benzenetriol 2607
                    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 21552
    subatomic particle 21537
      composite particle 21537
        hadron 21537
          baryon 21537
            nucleon 21537
              atomic nucleus 21537
                atom 21537
                  main group element atom 21442
                    p-block element atom 21442
                      chalcogen 20515
                        oxygen atom 20492
                          oxygen molecular entity 20492
                            hydroxides 20130
                              organic hydroxy compound 19164
                                polyol 7904
                                  triol 6070
                                    benzenetriol 2607
                                      2-amino-4-(3,4,5-trihydroxyphenyl)buta-1,3-diene-1,1,3-tricarbonitrile 0
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