Compound Identification
SMILES
COC(=O)C(CC1=CC=C(C=C1)C1=CC(CNC2=NC=CS2)=CC=C1)NS(=O)(=O)C1=C(C)C=C(C)C=C1C
InChIKey
InChIKey=JTGCFXHNGMRBLF-UHFFFAOYSA-N
Formula
C29H31N3O4S2
Mass
549.7
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
Alpha amino acid esters Biphenyls and derivatives Amphetamines and derivatives Benzenesulfonamides Benzenesulfonyl compounds Benzylamines Fatty acid esters Organosulfonamides 2-amino-1,3-thiazoles Heteroaromatic compounds Aminosulfonyl compounds Methyl esters Azacyclic compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Carbonyl compounds Organic oxides Amines
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylalanine or derivatives - Alpha-amino acid ester - Biphenyl - Amphetamine or derivatives - Benzenesulfonamide - Benzenesulfonyl group - Benzylamine - Fatty acid ester - Monocyclic benzene moiety - Organosulfonic acid amide - Benzenoid - Fatty acyl - 1,3-thiazol-2-amine - Aminosulfonyl compound - Thiazole - Sulfonyl - Azole - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Methyl ester - Heteroaromatic compound - Carboxylic acid ester - Organoheterocyclic compound - Azacycle - Monocarboxylic acid or derivatives - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organosulfur compound - Organic oxygen compound - Organonitrogen compound - 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