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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:3-[[1-(1,3-benzodioxol-5-ylmethyl)-5-tetrazolyl]-(1-pyrrolidinyl)methyl]-8-methyl-1H-quinolin-2-one
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Accession:CHEBI:120040 term browser browse the term
Definition:A quinoline that has formula C24H24N6O3.
Synonyms:related_synonym: Formula=C24H24N6O3;   InChI=1S/C24H24N6O3/c1-15-5-4-6-17-12-18(24(31)25-21(15)17)22(29-9-2-3-10-29)23-26-27-28-30(23)13-16-7-8-19-20(11-16)33-14-32-19/h4-8,11-12,22H,2-3,9-10,13-14H2,1H3,(H,25,31);   InChIKey=RYCAEYBFASCZEV-UHFFFAOYSA-N;   SMILES=CC1=CC=CC2=C1NC(=O)C(=C2)C(C3=NN=NN3CC4=CC5=C(C=C4)OCO5)N6CCCC6
 xref: LINCS:LSM-31483



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            organic molecule 0
              organic cyclic compound 0
                organic aromatic compound 0
                  quinolines 0
                    3-[[1-(1,3-benzodioxol-5-ylmethyl)-5-tetrazolyl]-(1-pyrrolidinyl)methyl]-8-methyl-1H-quinolin-2-one 0
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  CHEBI ontology 0
    subatomic particle 0
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                  main group element atom 0
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                                  organonitrogen heterocyclic compound 0
                                    quinolines 0
                                      3-[[1-(1,3-benzodioxol-5-ylmethyl)-5-tetrazolyl]-(1-pyrrolidinyl)methyl]-8-methyl-1H-quinolin-2-one 0
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