Compound Identification
SMILES
NCCC1=C(N=CN1)C(N)=O.N[C@@H](CC1=CC=C(F)C=C1)C(O)=O
InChIKey
InChIKey=KQJRVSCFWSETLX-QRPNPIFTSA-N
Formula
C15H20FN5O3
Mass
337.355
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
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Level 6
Alpha amino acids and derivatives
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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
Phenylpropanoic acids Amphetamines and derivatives L-alpha-amino acids 2-arylethylamines 2-heteroaryl carboxamides Aralkylamines Carbonylimidazoles Fluorobenzenes Aryl fluorides Heteroaromatic compounds Vinylogous amides Amino acids Primary carboxylic acid amides Carboxylic acids Monocarboxylic acids and derivatives Azacyclic compounds Monoalkylamines Carbonyl compounds Organic oxides Organofluorides Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
Phenylalanine or derivatives - 3-phenylpropanoic-acid - Alpha-amino acid - Amphetamine or derivatives - L-alpha-amino acid - 2-heteroaryl carboxamide - 2-arylethylamine - Halobenzene - Fluorobenzene - Imidazole-4-carbonyl group - Aralkylamine - Monocyclic benzene moiety - Benzenoid - Aryl fluoride - Aryl halide - Vinylogous amide - Imidazole - Azole - Heteroaromatic compound - Carboxamide group - Primary carboxylic acid amide - Amino acid - Azacycle - Organoheterocyclic compound - Carboxylic acid - Monocarboxylic acid or derivatives - Organonitrogen compound - Organic oxygen compound - Organooxygen compound - Primary amine - Carbonyl group - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organofluoride - Organohalogen compound - Primary aliphatic amine - 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