Compound Identification
SMILES
COC1=C(C2=C(C=C1)C(C(=O)N[C@@H](CCC(O)=O)C(O)=O)=C(Br)C=C2)C(F)(F)F
InChIKey
InChIKey=RYWCZYUPVZVLMV-NSHDSACASA-N
Formula
C18H15BrF3NO6
Mass
478.218
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
-
Level 5
Amino acids and derivatives
-
Level 6
Alpha amino acids and derivatives
- Level 7 Glutamic acid and derivatives
-
Level 6
Alpha amino acids and derivatives
-
Level 5
Amino acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
-
Class
Carboxylic acids and derivatives
-
Superclass
Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Carboxylic acids and derivatives
Subclass
Amino acids, peptides, and analogues
Intermediate Tree Nodes
Amino acids and derivatives - Alpha amino acids and derivatives
Direct Parent
Glutamic acid and derivatives
Alternative Parents
Naphthalenecarboxamides N-acyl-alpha amino acids 2-halobenzoic acids and derivatives Anisoles Alkyl aryl ethers Aryl bromides Dicarboxylic acids and derivatives Vinylogous halides Secondary carboxylic acid amides Carboxylic acids Hydrocarbon derivatives Carbonyl compounds Organic oxides Organobromides Alkyl fluorides Organofluorides Organonitrogen compounds
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Glutamic acid or derivatives - N-acyl-alpha-amino acid - N-acyl-alpha amino acid or derivatives - 1-naphthalenecarboxamide - 1-naphthalenecarboxylic acid or derivatives - Naphthalene - 2-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Phenol ether - Anisole - Alkyl aryl ether - Benzenoid - Aryl bromide - Aryl halide - Dicarboxylic acid or derivatives - Vinylogous halide - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid - Ether - Alkyl fluoride - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organohalogen compound - Carbonyl group - Organobromide - Organofluoride - Organonitrogen compound - Alkyl halide - Organooxygen compound - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as glutamic acid and derivatives. These are compounds containing glutamic acid or a derivative thereof resulting from reaction of glutamic acid at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
External Descriptors
Not available