Compound Identification
SMILES
COC(=O)C(CC1=CC(F)=CC=C1)NC(=O)\C=C\C1=CC(OC)=C(O)C(OC)=C1
InChIKey
InChIKey=RGGGFAACHCCPDR-BQYQJAHWSA-N
Formula
C21H22FNO6
Mass
403.406
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
-
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
Alpha amino acid esters N-acyl-alpha amino acids and derivatives Cinnamic acid amides Hydroxycinnamic acids and derivatives Dimethoxybenzenes Amphetamines and derivatives Methoxyphenols Styrenes Phenoxy compounds Anisoles Alkyl aryl ethers Fatty acid esters Fluorobenzenes Aryl fluorides Methyl esters Secondary carboxylic acid amides Monocarboxylic acids and derivatives Carbonyl compounds Hydrocarbon derivatives Organic oxides Organofluorides Organonitrogen compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Phenylalanine or derivatives - N-acyl-alpha amino acid or derivatives - Alpha-amino acid ester - Hydroxycinnamic acid or derivatives - Cinnamic acid or derivatives - Cinnamic acid amide - M-dimethoxybenzene - Dimethoxybenzene - Methoxyphenol - Amphetamine or derivatives - Methoxybenzene - Styrene - Phenol ether - Anisole - Phenoxy compound - Alkyl aryl ether - Fatty acid ester - Fluorobenzene - Phenol - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Methyl ester - Secondary carboxylic acid amide - Carboxylic acid ester - Carboxamide group - Ether - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Aromatic homomonocyclic 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