Send us a Message



Submit Data |  Help |  Video Tutorials |  News |  Publications |  Download |  REST API |  Citing RGD |  Contact   

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 5-O-beta-D-glucoside 3-O-beta-D-sambubioside betaine
go back to main search page
Accession:CHEBI:77944 term browser browse the term
Definition:An oxonium betaine obtained by deprotonation of the 7-hydroxy group of any anthocyanidin 5-O-beta-D-glucoside 3-O-beta-D-sambubioside. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.).
Synonyms:related_synonym: Formula=C32H36O19R2;   SMILES=OC[C@H]1O[C@@H](Oc2cc([O-])cc3[o+]c(c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4OC[C@@H](O)[C@H](O)[C@H]4O)cc23)-c2cc([*])c(O)c([*])c2)[C@H](O)[C@@H](O)[C@@H]1O;   an anthocyanidin 5-O-beta-D-glucoside 3-O-beta-D-sambubioside
 cyclic_relationship: is_conjugate_base_of CHEBI:71507


show annotations for term's descendants           Sort by:
 

Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 21763
    chemical entity 21761
      molecular entity 21748
        polyatomic entity 21641
          molecule 21289
            organic molecule 21279
              dipolar compound 1102
                zwitterion 1101
                  onium betaine 427
                    oxonium betaine 0
                      anthocyanidin 5-O-beta-D-glucoside 3-O-beta-D-sambubioside betaine 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 21763
    subatomic particle 21749
      composite particle 21749
        hadron 21749
          baryon 21749
            nucleon 21749
              atomic nucleus 21749
                atom 21749
                  main group element atom 21666
                    p-block element atom 21666
                      carbon group element atom 21478
                        carbon atom 21379
                          organic molecular entity 21379
                            organic molecule 21279
                              dipolar compound 1102
                                zwitterion 1101
                                  onium betaine 427
                                    oxonium betaine 0
                                      anthocyanidin 5-O-beta-D-glucoside 3-O-beta-D-sambubioside betaine 0
paths to the root