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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:4-(1-azepanyl)-6-hydrazinyl-N-(4-nitrophenyl)-1,3,5-triazin-2-amine
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Accession:CHEBI:107541 term browser browse the term
Definition:A C-nitro compound that has formula C15H20N8O2.
Synonyms:related_synonym: Formula=C15H20N8O2;   InChI=1S/C15H20N8O2/c16-21-14-18-13(17-11-5-7-12(8-6-11)23(24)25)19-15(20-14)22-9-3-1-2-4-10-22/h5-8H,1-4,9-10,16H2,(H2,17,18,19,20,21);   InChIKey=MNWXQCNWVLHIEE-UHFFFAOYSA-N;   SMILES=C1CCCN(CC1)C2=NC(=NC(=N2)NN)NC3=CC=C(C=C3)[N+](=O)[O-]
 xref: LINCS:LSM-18897


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  CHEBI ontology 19811
    chemical entity 19840
      group 19768
        inorganic group 19361
          nitro group 11131
            nitro compound 11131
              C-nitro compound 10843
                4-(1-azepanyl)-6-hydrazinyl-N-(4-nitrophenyl)-1,3,5-triazin-2-amine 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19811
    subatomic particle 19809
      composite particle 19809
        hadron 19840
          baryon 19809
            nucleon 19809
              atomic nucleus 19809
                atom 19809
                  main group element atom 19759
                    p-block element atom 19759
                      carbon group element atom 19708
                        carbon atom 19734
                          organic molecular entity 19705
                            organic molecule 19658
                              C-nitro compound 10843
                                4-(1-azepanyl)-6-hydrazinyl-N-(4-nitrophenyl)-1,3,5-triazin-2-amine 0
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