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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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Path 1
Term Annotations click to browse term
  CHEBI ontology 22210
    chemical entity 22209
      group 22105
        inorganic group 21060
          nitro group 11249
            nitro compound 11249
              N-[(8-methoxy-5-nitro-7-quinolinyl)-thiophen-2-ylmethyl]propanamide 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 22210
    subatomic particle 22202
      composite particle 22202
        hadron 22202
          baryon 22202
            nucleon 22202
              atomic nucleus 22202
                atom 22202
                  main group element atom 22136
                    p-block element atom 22136
                      carbon group element atom 21936
                        carbon atom 21861
                          organic molecular entity 21861
                            organic molecule 21678
                              organic cyclic compound 21285
                                organic heterocyclic compound 20357
                                  organonitrogen heterocyclic compound 19100
                                    quinolines 2657
                                      N-[(8-methoxy-5-nitro-7-quinolinyl)-thiophen-2-ylmethyl]propanamide 0
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