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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:beta-saxitoxinol(2+)
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Accession:CHEBI:189097 term browser browse the term
Definition:An iminium ion resulting from the protonation of the two imine groups of beta-saxitoxinol; major microspecies at pH 7.3.
Synonyms:related_synonym: Formula=C10H19N7O3;   InChI=1S/C10H17N7O3/c11-7-15-6-4(3-20-9(13)19)14-8(12)17-2-1-5(18)10(6,17)16-7/h4-6,18H,1-3H2,(H2,12,14)(H2,13,19)(H3,11,15,16)/p+2/t4-,5-,6-,10+/m0/s1;   InChIKey=NILHUXIFTLLDPJ-AVGUDYQDSA-P;   SMILES=N1C(N2[C@@]3([C@]([C@@H]1COC(N)=O)(NC(N3)=[NH2+])[H])[C@H](CC2)O)=[NH2+];   beta-STOH(2+);   beta-saxitoxinol
 xref: PMID:32532989


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Term Annotations click to browse term
  CHEBI ontology 1274
    role 1274
      biological role 1274
        biochemical role 459
          metabolite 450
            alkaloid 14
              beta-saxitoxinol(2+) 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 1274
    subatomic particle 1274
      composite particle 1274
        hadron 1274
          baryon 1274
            nucleon 1274
              atomic nucleus 1274
                atom 1274
                  main group element atom 1267
                    p-block element atom 1267
                      carbon group element atom 1257
                        carbon atom 1256
                          organic molecular entity 1256
                            organic molecule 1245
                              organic cyclic compound 1229
                                organic heterocyclic compound 417
                                  organic heteropolycyclic compound 95
                                    organic heterotricyclic compound 24
                                      pyrrolopurine 0
                                        beta-saxitoxinol(2+) 0
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