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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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          N-(trans-4'-nitro-4-stilbenyl)-N-methyl-5-aminopentanoic acid 0
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  CHEBI ontology 0
    subatomic particle 0
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                        hydrogen molecular entity 0
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                            inorganic hydride 0
                              pnictogen hydride 0
                                nitrogen hydride 0
                                  azane 0
                                    ammonia 0
                                      organic amino compound 0
                                        tertiary amino compound 0
                                          tertiary amine 0
                                            N-(trans-4'-nitro-4-stilbenyl)-N-methyl-5-aminopentanoic acid 0
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