EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:48463 - N-(2,6-dichlorobenzoyl)-3-[6-(2,6-dimethoxyphenyl)-2-naphthyl]alanine

ChEBI IDCHEBI:48463
ChEBI NameN-(2,6-dichlorobenzoyl)-3-[6-(2,6-dimethoxyphenyl)-2-naphthyl]alanine
Stars
ASCII NameN-(2,6-dichlorobenzoyl)-3-[6-(2,6-dimethoxyphenyl)-2-naphthyl]alanine
DefinitionAn N-acyl amino acid that is N-(2,6-dichlorobenzoyl)alanine in which one of the hydrogens at the β position has been replaced by a N 6-(2,6-dimethoxyphenyl)-2-naphthyl group.
Last Modified13 April 2015
Submitterhcourrier
DownloadsMolfile
FormulaC28H23Cl2NO5
Net Charge0
Average Mass524.400
Monoisotopic Mass523.09533
SMILESCOc1cccc(OC)c1-c1ccc2cc(CC(NC(=O)c3c(Cl)cccc3Cl)C(=O)O)ccc2c1
InChIInChI=1S/C28H23Cl2NO5/c1-35-23-7-4-8-24(36-2)25(23)19-12-11-17-13-16(9-10-18(17)15-19)14-22(28(33)34)31-27(32)26-20(29)5-3-6-21(26)30/h3-13,15,22H,14H2,1-2H3,(H,31,32)(H,33,34)
InChIKeyFAMJWPBIAKZQIJ-UHFFFAOYSA-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)
N-(2,6-dichlorobenzoyl)-3-[6-(2,6-dimethoxyphenyl)-2-naphthyl]alanine (CHEBI:48463) has part 2,6-dichlorobenzoyl group (CHEBI:48625)
N-(2,6-dichlorobenzoyl)-3-[6-(2,6-dimethoxyphenyl)-2-naphthyl]alanine (CHEBI:48463) is a N-acyl-amino acid (CHEBI:51569)
N-(2,6-dichlorobenzoyl)-3-[6-(2,6-dimethoxyphenyl)-2-naphthyl]alanine (CHEBI:48463) is a dichlorobenzene (CHEBI:23697)
N-(2,6-dichlorobenzoyl)-3-[6-(2,6-dimethoxyphenyl)-2-naphthyl]alanine (CHEBI:48463) is a naphthalenes (CHEBI:25477)
N-(2,6-dichlorobenzoyl)-3-[6-(2,6-dimethoxyphenyl)-2-naphthyl]alanine (CHEBI:48463) is a non-proteinogenic amino acid derivative (CHEBI:83812)
IUPAC Name 
N-(2,6-dichlorobenzoyl)-3-[6-(2,6-dimethoxyphenyl)naphthalen-2-yl]alanine
Synonym  Source
2-[(2,6-dichlorobenzoyl)amino]-3-[6-(2,6-dimethoxyphenyl)-2-naphthyl]propanoic acidPatent
Manual XrefsDatabases
EP1870402Patent