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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:LY-310762
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Accession:CHEBI:140937 term browser browse the term
Definition:A member of the class of oxindoles that is 1-ethyl-3,3-dimethyl-1,3-dihydro-2H-indol-2-one in which the ethyl group has been substituted at position 2 by a 4-(p-fluorobenzoyl)piperidin-1-yl group. It is a potent and selective antagonist for the 5-hydroxytryptamine 1D (5-HT1D) receptor.
Synonyms:exact_synonym: 1-{2-[4-(4-fluorobenzoyl)piperidin-1-yl]ethyl}-3,3-dimethyl-1,3-dihydro-2H-indol-2-one
 related_synonym: Formula=C24H27FN2O2;   InChI=1S/C24H27FN2O2/c1-24(2)20-5-3-4-6-21(20)27(23(24)29)16-15-26-13-11-18(12-14-26)22(28)17-7-9-19(25)10-8-17/h3-10,18H,11-16H2,1-2H3;   InChIKey=KDXISMANFPJVJY-UHFFFAOYSA-N;   LY-310,762;   LY310762;   SMILES=FC1=CC=C(C(=O)C2CCN(CC2)CCN3C(=O)C(C=4C3=CC=CC4)(C)C)C=C1
 xref: PMID:15189767;   PMID:22462474;   PMID:23769743;   PMID:25854421;   PMID:26003124;   PMID:26586311;   PMID:28428755;   PMID:28771848;   Wikipedia:LY-310762
 cyclic_relationship: is_conjugate_base_of CHEBI:140938



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  CHEBI ontology 19911
    role 19887
      application 19723
        pharmaceutical 19559
          drug 19559
            receptor modulator 18990
              LY-310762 0
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  CHEBI ontology 19911
    subatomic particle 19909
      composite particle 19909
        hadron 19909
          baryon 19909
            nucleon 19909
              atomic nucleus 19909
                atom 19909
                  main group element atom 19859
                    p-block element atom 19859
                      carbon group element atom 19803
                        carbon atom 19799
                          organic molecular entity 19799
                            organic group 18986
                              organic divalent group 18961
                                organodiyl group 18961
                                  carbonyl group 18917
                                    carbonyl compound 18917
                                      carboxylic acid 18641
                                        carboacyl group 17703
                                          univalent carboacyl group 17703
                                            carbamoyl group 17548
                                              carboxamide 17548
                                                lactam 8399
                                                  gamma-lactam 6655
                                                    oxindoles 5885
                                                      LY-310762 0
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