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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:5-nonyloxytryptamine oxalate
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Accession:CHEBI:64147 term browser browse the term
Definition:An oxalate salt obtained by reaction of 5-nonyloxytryptamine with one equivalent of oxalic acid. 5-HT1B selective agonist, several times more potent than sumatriptan and inactive as a 5-HT1A agonist (Ki at 5-HT1B = 1 nM, selectivity over 5-HT1A > 300-fold).
Synonyms:exact_synonym: 2-[5-(nonyloxy)-1H-indol-3-yl]ethanamine ethanedioate
 related_synonym: 2-[5-(nonyloxy)-1H-indol-3-yl]ethanamine oxalate;   2-[5-(nonyloxy)-1H-indol-3-yl]ethanaminium hydrogen oxalate;   3-(2-aminoethyl)-5-nonyloxyindole oxalate;   Formula=C21H32N2O5;   InChI=1S/C19H30N2O.C2H2O4/c1-2-3-4-5-6-7-8-13-22-17-9-10-19-18(14-17)16(11-12-20)15-21-19;3-1(4)2(5)6/h9-10,14-15,21H,2-8,11-13,20H2,1H3;(H,3,4)(H,5,6);   InChIKey=JORSCLBFSAAOFR-UHFFFAOYSA-N;   O-nonylserotonin oxalate;   SMILES=OC(=O)C(O)=O.CCCCCCCCCOc1ccc2[nH]cc(CCN)c2c1
 xref: Reaxys:7065207



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Term Annotations click to browse term
  CHEBI ontology 501
    chemical entity 501
      molecular entity 501
        ion 32
          organic ion 19
            organic cation 11
              5-nonyloxytryptaminium(1+) 0
                5-nonyloxytryptamine oxalate 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 501
    subatomic particle 501
      composite particle 501
        hadron 501
          baryon 501
            nucleon 501
              atomic nucleus 501
                atom 501
                  main group element atom 494
                    p-block element atom 494
                      carbon group element atom 483
                        carbon atom 482
                          organic molecular entity 482
                            organic ion 19
                              organic anion 8
                                carboxylic acid anion 6
                                  dicarboxylic acid anion 3
                                    oxalate 3
                                      oxalate salt 0
                                        5-nonyloxytryptamine oxalate 0
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