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CHEBI:144862 - N2-[4-(2,4-dichlorophenoxy)butanoyl]-L-glutamine

ChEBI IDCHEBI:144862
ChEBI NameN2-[4-(2,4-dichlorophenoxy)butanoyl]-L-glutamine
Stars
ASCII NameN(2)-[4-(2,4-dichlorophenoxy)butanoyl]-L-glutamine
DefinitionAn N2-acyl-L-glutamine that is L-glutamine in which one of the hydrogens of the α-amino group has been replaced by a 4-(2,4-dichlorophenoxy)butanoyl group.
Last Modified17 September 2019
SubmitterGareth Owen
DownloadsMolfile
FormulaC15H18Cl2N2O5
Net Charge0
Average Mass377.224
Monoisotopic Mass376.05928
SMILESNC(=O)CC[C@H](NC(=O)CCCOc1ccc(Cl)cc1Cl)C(=O)O
InChIInChI=1S/C15H18Cl2N2O5/c16-9-3-5-12(10(17)8-9)24-7-1-2-14(21)19-11(15(22)23)4-6-13(18)20/h3,5,8,11H,1-2,4,6-7H2,(H2,18,20)(H,19,21)(H,22,23)/t11-/m0/s1
InChIKeyKDJOGNVMKQDCJK-NSHDSACASA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
N2-[4-(2,4-dichlorophenoxy)butanoyl]-L-glutamine (CHEBI:144862) has functional parent 2,4-DB (CHEBI:73173)
N2-[4-(2,4-dichlorophenoxy)butanoyl]-L-glutamine (CHEBI:144862) is a N2-acyl-L-glutamine (CHEBI:17008)
N2-[4-(2,4-dichlorophenoxy)butanoyl]-L-glutamine (CHEBI:144862) is a aromatic ether (CHEBI:35618)
N2-[4-(2,4-dichlorophenoxy)butanoyl]-L-glutamine (CHEBI:144862) is a dichlorobenzene (CHEBI:23697)
N2-[4-(2,4-dichlorophenoxy)butanoyl]-L-glutamine (CHEBI:144862) is conjugate acid of N2-[4-(2,4-dichlorophenoxy)butanoyl]-L-glutamine(1−) (CHEBI:143278)
Incoming Relation(s)
N2-[4-(2,4-dichlorophenoxy)butanoyl]-L-glutamine(1−) (CHEBI:143278) is conjugate base of N2-[4-(2,4-dichlorophenoxy)butanoyl]-L-glutamine (CHEBI:144862)
IUPAC Name 
N2-[4-(2,4-dichlorophenoxy)butanoyl]-L-glutamine
Synonym  Source
(2S)-5-amino-2-[4-(2,4-dichlorophenoxy)butanoylamino]-5-oxopentanoic acidChEBI
Citations