Compound Identification
SMILES
COC(=O)C(CC1=CC=C(NC(=O)C2=C(Cl)C=CC=C2Cl)C=C1)NC(=S)C1(CCCSC)CCC1
InChIKey
InChIKey=MLCFEVXZCILGJS-UHFFFAOYSA-N
Formula
C26H30Cl2N2O3S2
Mass
553.56
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
-
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
Benzanilides Alpha amino acid esters 2-halobenzoic acids and derivatives Amphetamines and derivatives Benzamides Benzoyl derivatives Dichlorobenzenes Fatty acid esters Aryl chlorides Methyl esters Thioamides Vinylogous halides Secondary carboxylic acid amides Monocarboxylic acids and derivatives Sulfenyl compounds Dialkylthioethers Thiocarboxylic acid amides Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides Organonitrogen compounds Thiocarbonyl compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Phenylalanine or derivatives - Benzanilide - Aromatic anilide - Alpha-amino acid ester - Amphetamine or derivatives - 2-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzamide - Benzoic acid or derivatives - 1,3-dichlorobenzene - Benzoyl - Halobenzene - Fatty acid ester - Chlorobenzene - Aryl chloride - Aryl halide - Fatty acyl - Monocyclic benzene moiety - Benzenoid - Thioamide - Methyl ester - Vinylogous halide - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Monocarboxylic acid or derivatives - Dialkylthioether - Sulfenyl compound - Thioether - Thiocarboxylic acid amide - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Thiocarbonyl group - Organosulfur compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organochloride - 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