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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:alizarin complexone
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Accession:CHEBI:53088 term browser browse the term
Definition:A dihydroxyanthraquinone compound in which the hydroxy groups are at C-1 and C-2 and which has a bis[(carboxymethyl)amino]methyl substituent at the 3-position.
Synonyms:exact_synonym: 2,2'-{[(3,4-dihydroxy-9,10-dioxo-9,10-dihydroanthracen-2-yl)methyl]imino}diacetic acid
 related_synonym: 1,2-Dihydroxy-anthrachinon-3-methylen-iminodiessigsaeure;   3,4-Dihydroxyanthraquinon-2-ylmethyliminodi(acetic acid);   3-Aminomethylalizarin-N,N-diacetic acid;   Alizarin Fluorine Blue;   Alizarin complexon;   Alizarine Fluorine Blue;   Alizarine complexon;   Alizarine complexone;   Alizarinkomplexon;   Az-C;   Formula=C19H15NO8;   InChI=1S/C19H15NO8/c21-13(22)7-20(8-14(23)24)6-9-5-12-15(19(28)16(9)25)18(27)11-4-2-1-3-10(11)17(12)26/h1-5,25,28H,6-8H2,(H,21,22)(H,23,24);   InChIKey=PWIGYBONXWGOQE-UHFFFAOYSA-N;   SMILES=OC(=O)CN(CC(O)=O)Cc1cc2C(=O)c3ccccc3C(=O)c2c(O)c1O;   {[(3,4-Dihydroxy-2-anthraquinonyl)methyl]imino}diacetic acid dihydrate
 xref: Beilstein:2190028;   CAS:3952-78-1;   Gmelin:63214;   PMID:14500876


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        reagent 0
          colorimetric reagent 0
            alizarin complexone 0
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  CHEBI ontology 0
    subatomic particle 0
      composite particle 0
        hadron 0
          baryon 0
            nucleon 0
              atomic nucleus 0
                atom 0
                  main group element atom 0
                    p-block element atom 0
                      carbon group element atom 0
                        carbon atom 0
                          organic molecular entity 0
                            organic group 0
                              organic divalent group 0
                                organodiyl group 0
                                  carbonyl group 0
                                    carbonyl compound 0
                                      ketone 0
                                        cyclic ketone 0
                                          quinone 0
                                            acenoquinone 0
                                              anthraquinone 0
                                                hydroxyanthraquinones 0
                                                  dihydroxyanthraquinone 0
                                                    alizarin complexone 0
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