Compound Identification
SMILES
OC(=O)C(C(C1CNC2=C1N=CC=C2)C1=CC=CC=C1)C(O)=O
InChIKey
InChIKey=TULRSJACGCYRDL-UHFFFAOYSA-N
Formula
C17H16N2O4
Mass
312.325
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
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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
Direct Parent
Delta amino acids and derivatives
Alternative Parents
Phenylpropanoic acids Pyrrolopyridines Secondary alkylarylamines Aralkylamines Pyridines and derivatives Dicarboxylic acids and derivatives Benzene and substituted derivatives 1,3-dicarbonyl compounds Heteroaromatic compounds Amino acids Carboxylic acids Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Delta amino acid or derivatives - 3-phenylpropanoic-acid - Pyrrolopyridine - Secondary aliphatic/aromatic amine - Aralkylamine - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Pyridine - 1,3-dicarbonyl compound - Benzenoid - Heteroaromatic compound - Amino acid - Secondary amine - Carboxylic acid - Organoheterocyclic compound - Azacycle - Carbonyl group - Organic oxide - Amine - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as delta amino acids and derivatives. These are compounds containing a carboxylic acid group and an amino group at the C5 carbon atom.
External Descriptors
Not available