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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:anthocyanidin 3-O-(6-O-malonyl-beta-D-glucoside) betaine
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Accession:CHEBI:84163 term browser browse the term
Definition:An oxonium betaine obtained by deprotonation of the carboxy group of any anthocyanidin 3-O-(6-O-malonyl-beta-D-glucoside). It is the major microspecies at pH 7.3.
Synonyms:related_synonym: Formula=C24H20O13R2;   SMILES=O[C@H]1[C@H](O)[C@@H](COC(=O)CC([O-])=O)O[C@@H](Oc2cc3c(O)cc(O)cc3[o+]c2-c2cc([*])c(O)c([*])c2)[C@@H]1O;   an anthocyanidin 3-O-(6-O-malonyl-beta-D-glucoside)
 cyclic_relationship: is_conjugate_base_of CHEBI:55410


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Path 1
Term Annotations click to browse term
  CHEBI ontology 400
    chemical entity 400
      molecular entity 400
        polyatomic entity 393
          molecule 374
            organic molecule 371
              dipolar compound 1
                zwitterion 1
                  onium betaine 1
                    oxonium betaine 0
                      anthocyanidin 3-O-(6-O-malonyl-beta-D-glucoside) betaine 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 400
    subatomic particle 400
      composite particle 400
        hadron 400
          baryon 400
            nucleon 400
              atomic nucleus 400
                atom 400
                  main group element atom 393
                    p-block element atom 393
                      carbon group element atom 381
                        carbon atom 380
                          organic molecular entity 380
                            organic molecule 371
                              dipolar compound 1
                                zwitterion 1
                                  onium betaine 1
                                    oxonium betaine 0
                                      anthocyanidin 3-O-(6-O-malonyl-beta-D-glucoside) betaine 0
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