Compound Identification
SMILES
OC(=O)C(CC1=CC=C(C=C1)C1=CC=C(C=C1)C#N)NC(=O)[C@@H]1CC2=CC3=C(O[C@H](CO3)C3=CC=C(OCC4=CC(Cl)=C(Cl)C=C4)C=C3)C=C2CN1C(=O)C#CC1=CC=CC=C1
InChIKey
InChIKey=FUEWTSQUZDUBBJ-MVXUEPLZSA-N
Formula
C50H37Cl2N3O7
Mass
862.76
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
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Subclass
Amino acids, peptides, and analogues
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Level 5
Amino acids and derivatives
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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
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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 - Alpha amino acids and derivatives
Direct Parent
Phenylalanine and derivatives
Alternative Parents
Phenylbenzo-1,4-dioxanes Biphenylcarbonitriles N-acyl-alpha amino acids Alpha amino acid amides Phenylpropanoic acids Tetrahydroisoquinolines Amphetamines and derivatives Benzo-1,4-dioxanes Phenoxy compounds Benzonitriles Phenol ethers Dichlorobenzenes Alkyl aryl ethers Para dioxins Aryl chlorides Tertiary carboxylic acid amides Secondary carboxylic acid amides Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Nitriles Oxacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylalanine or derivatives - 2-phenylbenzo-1,4-dioxane - Phenylbenzodioxane - Biphenylcarbonitrile - N-acyl-alpha amino acid or derivatives - N-acyl-alpha-amino acid - Biphenyl - Alpha-amino acid amide - 3-phenylpropanoic-acid - Benzodioxane - Tetrahydroisoquinoline - Amphetamine or derivatives - Benzo-1,4-dioxane - 1,2-dichlorobenzene - Benzonitrile - Phenoxy compound - Phenol ether - Halobenzene - Alkyl aryl ether - Chlorobenzene - Para-dioxin - Benzenoid - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Tertiary carboxylic acid amide - Carboxamide group - Secondary carboxylic acid amide - Nitrile - Monocarboxylic acid or derivatives - Carbonitrile - Ether - Oxacycle - Azacycle - Carboxylic acid - Organoheterocyclic compound - Organohalogen compound - Organooxygen compound - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Organochloride - Hydrocarbon derivative - Organic oxide - Cyanide - Organic oxygen compound - Aromatic heteropolycyclic 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