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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:atropine
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Accession:CHEBI:16684 term browser browse the term
Definition:A racemate composed of equimolar concentrations of (S)- and (R)-atropine . It is obtained from deadly nightshade (Atropa belladonna) and other plants of the family Solanaceae.
Synonyms:exact_synonym: rac-(3-endo)-8-methyl-8-azabicyclo[3.2.1]oct-3-yl 3-hydroxy-2-phenylpropanoate;   rac-tropan-3alpha-yl 3-hydroxy-2-phenylpropanoate
 related_synonym: (+,-)-tropyl tropate;   (+-)-hyoscyamine;   (3-endo)-8-methyl-8-azabicyclo[3.2.1]oct-3-yl tropate;   8-methyl-8-azabicyclo[3.2.1]oct-3-yl 3-hydroxy-2-phenylpropanoate;   8-methyl-8-azabicyclo[3.2.1]oct-3-yl tropate;   Atropin;   Formula=C17H23NO3;   InChI=1S/C17H23NO3/c1-18-13-7-8-14(18)10-15(9-13)21-17(20)16(11-19)12-5-3-2-4-6-12/h2-6,13-16,19H,7-11H2,1H3/t13-,14+,15+,16?;   InChIKey=RKUNBYITZUJHSG-SPUOUPEWSA-N;   SMILES=CN1[C@H]2CC[C@@H]1C[C@@H](C2)OC(=O)C(CO)c1ccccc1;   [(1S,5R)-8-methyl-8-azabicyclo[3.2.1]oct-3-yl] 3-hydroxy-2-phenyl-propanoate;   atropina;   dl-Hyoscyamine;   dl-tropyltropate;   tropine tropate
 alt_id: CHEBI:13866;   CHEBI:22674;   CHEBI:24754;   CHEBI:2917
 xref: Beilstein:1545928;   Beilstein:4236545;   CAS:51-55-8;   DrugBank:DB00572;   HMDB:HMDB0014712;   KEGG:C01479;   KEGG:D00113
 xref_mesh: MESH:D001285
 xref: PMID:15374592;   PMID:18369575;   Reaxys:1545928

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Term Annotations click to browse term
  CHEBI ontology 0
    chemical entity 0
      chemical substance 0
        mixture 0
          racemate 0
            atropine 0
              (6S)-6-hydroxyhyoscyamine 0
              hyoscyamine sulfate dihydrate 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 0
    subatomic particle 0
      composite particle 0
        hadron 0
          baryon 0
            nucleon 0
              atomic nucleus 0
                atom 0
                  main group element atom 0
                    p-block element atom 0
                      carbon group element atom 0
                        carbon atom 0
                          organic molecular entity 0
                            heteroorganic entity 0
                              organochalcogen compound 0
                                organooxygen compound 0
                                  carbon oxoacid 0
                                    carboxylic acid 0
                                      monocarboxylic acid 0
                                        fatty acid 0
                                          saturated fatty acid 0
                                            propionic acid 0
                                              2-arylpropionic acid 0
                                                hydratropic acid 0
                                                  (S)-hydratropic acid 0
                                                    (R)-tropic acid 0
                                                      (R)-atropine 0
                                                        atropine 0
                                                          (6S)-6-hydroxyhyoscyamine 0
                                                          hyoscyamine sulfate dihydrate 0
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