Compound Identification
SMILES
COC(=O)C1=C(O)C=CC=C1OCCCCCNC(=O)[C@H](CC1=CC(Cl)=C(C=C1)[C@@H]1CC(=O)NS1(=O)=O)NS(=O)(=O)C1=CC=CC=C1
InChIKey
InChIKey=LZJDVHWALQMKBR-IGKIAQTJSA-N
Formula
C31H34ClN3O10S2
Mass
708.19
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 amides o-Hydroxybenzoic acid esters Salicylic acid and derivatives Amphetamines and derivatives Benzenesulfonamides Benzenesulfonyl compounds Phenoxy compounds Phenol ethers Benzoyl derivatives 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Alkyl aryl ethers Gamma sultams Chlorobenzenes Organosulfonamides Aryl chlorides Fatty amides Methyl esters Aminosulfonyl compounds Vinylogous acids Secondary carboxylic acid amides Azacyclic compounds Organic oxides Organochlorides Organonitrogen compounds Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylalanine or derivatives - Alpha-amino acid amide - O-hydroxybenzoic acid ester - Salicylic acid or derivatives - Benzoate ester - Benzenesulfonamide - Amphetamine or derivatives - Benzenesulfonyl group - Benzoic acid or derivatives - Phenoxy compound - Phenol ether - Benzoyl - Alkyl aryl ether - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Halobenzene - Gamma-sultam - Phenol - Thiazolidinedione - Chlorobenzene - Organosulfonic acid amide - Fatty amide - Benzenoid - Monocyclic benzene moiety - Fatty acyl - Aryl halide - Aryl chloride - Vinylogous acid - Methyl ester - Aminosulfonyl compound - Thiazolidine - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Secondary carboxylic acid amide - Carboxylic acid ester - Carboxamide group - Azacycle - Ether - Organoheterocyclic compound - Organosulfur compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - 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
CHEBI:47500 : organochlorine compound - benzoate ester - thiazolidinone - mixed diacylamine