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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:N-[(8-methoxy-5-nitro-7-quinolinyl)-thiophen-2-ylmethyl]propanamide
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Accession:CHEBI:91974 term browser browse the term
Definition:A nitro compound that has formula C18H17N3O4S.
Synonyms:related_synonym: Formula=C18H17N3O4S;   InChI=1S/C18H17N3O4S/c1-3-15(22)20-16(14-7-5-9-26-14)12-10-13(21(23)24)11-6-4-8-19-17(11)18(12)25-2/h4-10,16H,3H2,1-2H3,(H,20,22);   InChIKey=MVSDRWFMCCQNRB-UHFFFAOYSA-N;   SMILES=CCC(=O)NC(C1=CC=CS1)C2=CC(=C3C=CC=NC3=C2OC)[N+](=O)[O-]
 xref: LINCS:LSM-1935


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Term Annotations click to browse term
  CHEBI ontology 26050
    chemical entity 26029
      group 25892
        inorganic group 24585
          nitro group 12396
            nitro compound 12396
              N-[(8-methoxy-5-nitro-7-quinolinyl)-thiophen-2-ylmethyl]propanamide 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 26050
    subatomic particle 26025
      composite particle 26025
        hadron 26025
          baryon 26025
            nucleon 26025
              atomic nucleus 26025
                atom 26025
                  main group element atom 25850
                    p-block element atom 25850
                      carbon group element atom 25447
                        carbon atom 25405
                          organic molecular entity 25405
                            organic molecule 25233
                              organic cyclic compound 24287
                                organic heterocyclic compound 22334
                                  organonitrogen heterocyclic compound 20350
                                    quinolines 2685
                                      N-[(8-methoxy-5-nitro-7-quinolinyl)-thiophen-2-ylmethyl]propanamide 0
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