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Accession:CHEBI:133919 term browser browse the term
Definition:A pyrrolopurine that is 2,6-diiminodecahydropyrrolo[1,2-c]purine carrying an additional hydroxymethyl substituent at position 4 as well as two hydroxy substituents at position 10. A toxin that is isolated from marine dinoflagellates and cyanobacteria and is known to cause paralytic shellfish poisoning.
Synonyms:exact_synonym: (3aS,4R,10aS)-2,6-diamino-4-(hydroxymethyl)-3a,4,8,9-tetrahydro-1H,8H-pyrrolo[1,2-c]purine-10,10-diol
 related_synonym: 4-(hydroxymethyl)-2,6-diimino-decahydropyrrolo[1,2-c]purine-10,10-diol;   Dcstx-saxitoxin;   Decarbamylsaxitoxin;   Formula=C9H16N6O3;   InChI=1S/C9H16N6O3/c10-6-13-5-4(3-16)12-7(11)15-2-1-8(17,18)9(5,15)14-6/h4-5,16-18H,1-3H2,(H2,11,12)(H3,10,13,14)/t4-,5-,9-/m0/s1;   InChIKey=VRRIYZJUSNMZMP-PJPYAQQDSA-N;   SMILES=N1C(N2[C@@]3([C@]([C@@H]1CO)(NC(N3)=N)[H])C(CC2)(O)O)=N
 xref: AGR:IND44454658 "Europe PMC";   AGR:IND601134073 "Europe PMC";   CAS:58911-04-9 "ChemIDplus";   CAS:58911-04-9 "HMDB";   Chemspider:28574223;   HMDB:HMDB0038319;   PMID:12740803 "Europe PMC";   PMID:12924931 "Europe PMC";   PMID:15019474 "Europe PMC";   PMID:15146927 "Europe PMC";   PMID:16192070 "Europe PMC";   PMID:16536478 "Europe PMC";   PMID:16544882 "Europe PMC";   PMID:17370612 "Europe PMC";   PMID:17996918 "Europe PMC";   PMID:18232710 "Europe PMC";   PMID:20048055 "Europe PMC";   PMID:20355743 "Europe PMC";   PMID:20650063 "Europe PMC";   PMID:21619049 "Europe PMC";   PMID:22960450 "Europe PMC";   PMID:24334673 "Europe PMC";   PMID:24418175 "Europe PMC";   PMID:25213823 "Europe PMC";   PMID:26024657 "Europe PMC";   Reaxys:1145725 "Reaxys"

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  CHEBI ontology 19716
    role 19663
      biological role 19661
        xenobiotic 18261
          decarbamoylsaxitoxin 0
Path 2
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  CHEBI ontology 19716
    subatomic particle 19712
      composite particle 19712
        hadron 19712
          baryon 19712
            nucleon 19712
              atomic nucleus 19712
                atom 19712
                  main group element atom 19598
                    p-block element atom 19598
                      carbon group element atom 19486
                        carbon atom 19480
                          organic molecular entity 19480
                            organic molecule 19402
                              organic cyclic compound 19158
                                organic heterocyclic compound 18245
                                  organic heteropolycyclic compound 17500
                                    organic heterotricyclic compound 13738
                                      pyrrolopurine 1
                                        decarbamoylsaxitoxin 0
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