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ONTOLOGY REPORT - ANNOTATIONS


Term:actinodaphnine
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Accession:CHEBI:2444 term browser browse the term
Definition:An organic heteropentacyclic compound 6,7,7a,8-tetrahydro-5H-benzo[g][1,3]dioxolo[4',5':4,5]benzo[1,2,3-de]quinoline bering additional hydroxy and methoxy substituents at positions 10 and 11 respectively.
Synonyms:exact_synonym: (S)-11-methoxy-6,7,7a,8-tetrahydro-5H-benzo[g][1,3]dioxolo[4',5':4,5]benzo[1,2,3-de]quinolin-10-ol
 related_synonym: 1,2-Methylenedioxy-9-hydroxy-10-methoxynoraporphine;   Actinodaphine;   Formula=C18H17NO4;   InChI=1S/C18H17NO4/c1-21-14-7-11-10(5-13(14)20)4-12-16-9(2-3-19-12)6-15-18(17(11)16)23-8-22-15/h5-7,12,19-20H,2-4,8H2,1H3/t12-/m0/s1;   InChIKey=VYJUHRAQPIBWNV-LBPRGKRZSA-N;   SMILES=[H][C@@]12Cc3cc(O)c(OC)cc3-c3c4OCOc4cc(CCN1)c23
 xref: CAS:517-69-1 "ChemIDplus";   CAS:517-69-1 "KEGG COMPOUND";   CAS:517-69-1 "NIST Chemistry WebBook";   KEGG:C09322;   KNApSAcK:C00001790;   PMID:16168547 "Europe PMC";   PMID:2609975 "Europe PMC";   PMID:3267205 "Europe PMC";   Reaxys:44828 "Reaxys"


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  CHEBI ontology 19679
    role 19623
      biological role 19621
        antimicrobial agent 17158
          antibacterial agent 12907
            actinodaphnine 0
Path 2
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  CHEBI ontology 19679
    subatomic particle 19675
      composite particle 19675
        hadron 19675
          baryon 19675
            nucleon 19675
              atomic nucleus 19675
                atom 19675
                  main group element atom 19555
                    main group molecular entity 19555
                      s-block molecular entity 19336
                        hydrogen molecular entity 19325
                          hydrides 18249
                            inorganic hydride 17113
                              pnictogen hydride 17071
                                nitrogen hydride 16891
                                  azane 16568
                                    ammonia 16565
                                      organic amino compound 16564
                                        secondary amino compound 6365
                                          actinodaphnine 0
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