Compound Identification
SMILES
NCCC1=C(N=CN1)C(N)=O.CC(=O)N[C@@H](CC1=CC=CC=C1)C(O)=O
InChIKey
InChIKey=IETTWSDRSCPGCD-PPHPATTJSA-N
Formula
C17H23N5O4
Mass
361.402
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 Phenylalanine 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
Phenylalanine and derivatives
Alternative Parents
N-acyl-L-alpha-amino acids Phenylpropanoic acids Amphetamines and derivatives 2-arylethylamines 2-heteroaryl carboxamides Aralkylamines Carbonylimidazoles Heteroaromatic compounds Vinylogous amides Acetamides Secondary carboxylic acid amides Primary carboxylic acid amides Carboxylic acids Azacyclic compounds Monocarboxylic acids and derivatives Monoalkylamines Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Not available
Substituents
Phenylalanine or derivatives - N-acyl-alpha amino acid or derivatives - N-acyl-l-alpha-amino acid - N-acyl-alpha-amino acid - 3-phenylpropanoic-acid - Amphetamine or derivatives - 2-heteroaryl carboxamide - 2-arylethylamine - Imidazole-4-carbonyl group - Aralkylamine - Monocyclic benzene moiety - Benzenoid - Imidazole - Vinylogous amide - Azole - Heteroaromatic compound - Acetamide - Secondary carboxylic acid amide - Primary carboxylic acid amide - Carboxamide group - Azacycle - Carboxylic acid - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Primary aliphatic amine - Organic nitrogen compound - Amine - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic oxygen compound - Primary amine - Organooxygen compound - Organonitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylalanine and derivatives. These are compounds containing phenylalanine or a derivative thereof resulting from reaction of phenylalanine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
External Descriptors
Not available