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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:pentapiperium metilsulfate
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Accession:CHEBI:134707 term browser browse the term
Synonyms:related_synonym: Formula=C19H30NO2;   InChI=1S/C19H30NO2/c1-5-15(2)18(16-9-7-6-8-10-16)19(21)22-17-11-13-20(3,4)14-12-17/h6-10,15,17-18H,5,11-14H2,1-4H3/q+1;   InChIKey=WSWDKMFWJOALEW-UHFFFAOYSA-N;   SMILES=C1=CC=CC(=C1)C(C(OC2CC[N+](CC2)(C)C)=O)C(C)CC;   pentapiperide methylsulphate;   pentapiperium;   pentapiperium methylsulfate;   pentapiperium metilsulphate
 xref: CAS:7681-80-3;   Drug_Central:5073


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Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19767
    role 19714
      chemical role 19255
        environmental contaminant 18593
          benzene 5643
            alkylbenzene 3366
              pentapiperium metilsulfate 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19767
    subatomic particle 19766
      composite particle 19766
        hadron 19766
          baryon 19766
            nucleon 19766
              atomic nucleus 19766
                atom 19766
                  main group element atom 19657
                    main group molecular entity 19657
                      s-block molecular entity 19421
                        hydrogen molecular entity 19414
                          hydrides 18754
                            organic hydride 18358
                              organic fundamental parent 18358
                                hydrocarbon 18075
                                  cyclic hydrocarbon 17092
                                    monocyclic hydrocarbon 5816
                                      annulene 5643
                                        aromatic annulene 5643
                                          benzene 5643
                                            alkylbenzene 3366
                                              pentapiperium metilsulfate 0
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