CHEBI:53649 - N-(2,4-dinitro-6-carboxy)phenyl-1.6-diaminohexane

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ChEBI Name N-(2,4-dinitro-6-carboxy)phenyl-1.6-diaminohexane ChEBI ID CHEBI:53649 ChEBI ASCII Name N-(2,4-dinitro-6-carboxy)phenyl-1.6-diaminohexane Definition An N-substituted diamine that consists of 1,6-hexanediamine bearing a 2,4-dinitro-6-carboxyphenyl substituent. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C13H18N4O6 Net Charge 0 Average Mass 326.30520 Monoisotopic Mass 326.12263 InChI InChI=1S/C13H18N4O6/c14-5-3-1-2-4-6-15-12-10(13(18)19)7-9(16(20)21)8-11(12)17(22)23/h7-8,15H,1-6,14H2,(H,18,19) InChIKey PEGSMPHAYGPKIY-UHFFFAOYSA-N SMILES NCCCCCCNc1c(cc(cc1[N+]([O-])=O)[N+]([O-])=O)C(O)=O Roles Classification Chemical Role(s): Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid ) Bronsted base A molecular entity capable of accepting a hydron from a donor (Bronsted acid). (via organic amino compound ) View more via ChEBI Ontology ChEBI Ontology Outgoing N-(2,4-dinitro-6-carboxy)phenyl-1.6-diaminohexane (CHEBI:53649) has functional parent hexane-1,6-diamine (CHEBI:39618) N-(2,4-dinitro-6-carboxy)phenyl-1.6-diaminohexane (CHEBI:53649) is a C-nitro compound (CHEBI:35716) N-(2,4-dinitro-6-carboxy)phenyl-1.6-diaminohexane (CHEBI:53649) is a N-substituted diamine (CHEBI:50441) N-(2,4-dinitro-6-carboxy)phenyl-1.6-diaminohexane (CHEBI:53649) is a benzoic acids (CHEBI:22723) IUPAC Name 2-[(6-aminohexyl)amino]-3,5-dinitrobenzoic acid Synonym Source o-DNCP-HEX-NH2 ChEBI Registry Number Type Source 6534043 Beilstein Registry Number Beilstein Citation Type Source 6182245 PubMed citation Europe PMC Last Modified 27 October 2011