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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-(trans-4'-nitro-4-stilbenyl)-N-methyl-5-aminopentanoic acid
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Accession:CHEBI:46151 term browser browse the term
Definition:A C-nitro compound that is a stilbene derivative having an N-methyl,N-5-carboxypentylamino group at the 4-position and a nitro substituent at the 4'-position.
Synonyms:exact_synonym: 5-(methyl{4-[(E)-2-(4-nitrophenyl)ethenyl]phenyl}amino)pentanoic acid
 related_synonym: 5-(methyl{4-[(E)-2-(4-nitrophenyl)vinyl]phenyl}amino)pentanoic acid;   Formula=C20H22N2O4;   InChI=1S/C20H22N2O4/c1-21(15-3-2-4-20(23)24)18-11-7-16(8-12-18)5-6-17-9-13-19(14-10-17)22(25)26/h5-14H,2-4,15H2,1H3,(H,23,24)/b6-5+;   InChIKey=QLLZAVDYYAQESE-AATRIKPKSA-N;   SMILES=CN(CCCCC(O)=O)c1ccc(cc1)\\C=C\\c1ccc(cc1)[N+]([O-])=O
 xref: Beilstein:7102402;   DrugBank:DB08635;   PDB:2G2R;   PDBeChem:TNS;   PMID:17089439;   Reaxys:7102402



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Term Annotations click to browse term
  CHEBI ontology 26034
    role 25961
      biological role 25929
        epitope 7428
          N-(trans-4'-nitro-4-stilbenyl)-N-methyl-5-aminopentanoic acid 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 26034
    subatomic particle 26009
      composite particle 26009
        hadron 26020
          baryon 26009
            nucleon 26009
              atomic nucleus 26009
                atom 26009
                  main group element atom 25834
                    main group molecular entity 25834
                      s-block molecular entity 25166
                        hydrogen molecular entity 24765
                          hydrides 22965
                            inorganic hydride 20483
                              pnictogen hydride 20424
                                nitrogen hydride 20200
                                  azane 19942
                                    ammonia 19941
                                      organic amino compound 19941
                                        tertiary amino compound 10427
                                          tertiary amine 642
                                            N-(trans-4'-nitro-4-stilbenyl)-N-methyl-5-aminopentanoic acid 0
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