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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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Term Annotations click to browse term
  CHEBI ontology 24370
    role 24278
      application 23772
        reagent 19276
          colorimetric reagent 10
            alizarin complexone 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 24370
    subatomic particle 24327
      composite particle 24327
        hadron 24327
          baryon 24327
            nucleon 24327
              atomic nucleus 24327
                atom 24327
                  main group element atom 24173
                    p-block element atom 24173
                      carbon group element atom 23949
                        carbon atom 23906
                          organic molecular entity 23906
                            organic group 22190
                              organic divalent group 22164
                                organodiyl group 22164
                                  carbonyl group 22147
                                    carbonyl compound 22147
                                      ketone 18329
                                        cyclic ketone 14959
                                          quinone 8939
                                            acenoquinone 8053
                                              anthraquinone 489
                                                hydroxyanthraquinones 481
                                                  dihydroxyanthraquinone 342
                                                    alizarin complexone 0
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