Compound Identification
SMILES
CS(=O)(=O)C1=CC=CC(C[C@H](NC(=O)C2=CC3=C(CN(CC3Cl)C(=O)\C=C\C3=C(O)C=CC(F)=C3)C=C2Cl)C(O)=O)=C1
InChIKey
InChIKey=WTZBTTJXNRAUCK-LBEFJDSNSA-N
Formula
C29H25Cl2FN2O7S
Mass
635.48
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
N-acyl-alpha amino acids Coumaric acids and derivatives Phenylpropanoic acids Tetrahydroisoquinolines Amphetamines and derivatives 2-halobenzoic acids and derivatives Benzenesulfonyl compounds Styrenes P-fluorophenols Fluorobenzenes 1-hydroxy-2-unsubstituted benzenoids Aryl chlorides Aryl fluorides Sulfones Vinylogous halides Tertiary carboxylic acid amides Amino acids Tertiary amines Secondary carboxylic acid amides Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Hydrocarbon derivatives Organofluorides Organic oxides Organochlorides Alkyl chlorides Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylalanine or derivatives - N-acyl-alpha-amino acid - N-acyl-alpha amino acid or derivatives - Cinnamic acid or derivatives - Coumaric acid or derivatives - Hydroxycinnamic acid or derivatives - 3-phenylpropanoic-acid - Amphetamine or derivatives - Tetrahydroisoquinoline - 2-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzenesulfonyl group - 4-halophenol - 4-fluorophenol - Styrene - Halobenzene - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Fluorobenzene - Aryl halide - Monocyclic benzene moiety - Benzenoid - Aryl fluoride - Aryl chloride - Tertiary carboxylic acid amide - Sulfonyl - Sulfone - Vinylogous halide - Tertiary amine - Secondary carboxylic acid amide - Carboxamide group - Amino acid - Monocarboxylic acid or derivatives - Azacycle - Organoheterocyclic compound - Carboxylic acid - Organochloride - Organosulfur compound - Alkyl chloride - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Carbonyl group - Organic oxygen compound - Hydrocarbon derivative - Alkyl halide - Amine - Organic oxide - Organofluoride - Organohalogen 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