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ONTOLOGY REPORT - ANNOTATIONS


Term:isotalatizidine
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Accession:CHEBI:132628 term browser browse the term
Definition:A diterpene alkaloid that is aconitane bearing hydroxy groups at the 1alpha, 8, and 14alpha positions and substituted at on the nitrogen and at positions 4 and 16beta by ethyl, methoxymethyl, and methoxy groups, respectively.
Synonyms:exact_synonym: 20-ethyl-16beta-methoxy-4-(methoxymethyl)aconitane-1alpha,8,14alpha-triol
 related_synonym: (1alpha,14alpha,16beta)-20-ethyl-16-methoxy-4-(methoxymethyl)aconitane-1,8,14-triol;   Formula=C23H37NO5;   InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13-,14+,15+,16-,17+,18-,19+,20?,21+,22+,23-/m1/s1;   InChIKey=RBSZCNOWHDHRFZ-JPAZAREGSA-N;   SMILES=[C@@]123C4[C@@]([C@]5(C[C@@H]([C@]6(C[C@@]1([C@@]5([C@H]6O)[H])[H])[H])OC)O)(C[C@@]2([C@](CC[C@@H]3O)(COC)CN4CC)[H])[H]
 xref: CAS:7633-68-3 "ChemIDplus";   CAS:7633-68-3 "KNApSAcK";   CBA:335013 "Europe PMC";   CBA:337598 "Europe PMC";   CBA:338609 "Europe PMC";   KNApSAcK:C00028417;   PMID:11145143 "Europe PMC";   PMID:20862641 "Europe PMC";   PMID:23225552 "Europe PMC";   PMID:23876370 "Europe PMC";   PMID:6045606 "Europe PMC";   PMID:8368077 "Europe PMC";   PMID:9170290 "Europe PMC";   Pubchem:11452543 "SUBMITTER";   Reaxys:4940561 "Reaxys"


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  CHEBI ontology 19716
    role 19663
      application 19308
        refrigerant 17091
          ammonia 16690
            organic amino compound 16689
              tertiary amino compound 8527
                isotalatizidine 0
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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
                    main group molecular entity 19598
                      s-block molecular entity 19361
                        hydrogen molecular entity 19350
                          hydrides 18280
                            organic hydride 17546
                              organic fundamental parent 17546
                                hydrocarbon 16961
                                  terpene 9336
                                    terpenoid 9331
                                      diterpenoid 8269
                                        diterpene alkaloid 57
                                          aconitane 57
                                            isotalatizidine 0
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