Compound Identification
SMILES
CC(C)CN([C@@H](CCCCNC(=O)[C@H](CC1=CC=CC=C1)NC(C)=O)CC(O)=O)S(=O)(=O)C1=CC=C(C)C=C1
InChIKey
InChIKey=ROUQBFHOYAOIGM-BDYUSTAISA-N
Formula
C29H41N3O6S
Mass
559.72
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
-
Level 5
Amino acids and derivatives
-
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
N,N-disubstituted p-toluenesulfonamides N-acyl-alpha amino acids and derivatives Alpha amino acid amides Amphetamines and derivatives Benzenesulfonamides Benzenesulfonyl compounds Medium-chain fatty acids Branched fatty acids Organosulfonamides Fatty amides Acetamides Aminosulfonyl compounds Secondary carboxylic acid amides Monocarboxylic acids and derivatives Carboxylic acids Hydrocarbon derivatives Carbonyl compounds Organonitrogen compounds Organic oxides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Phenylalanine or derivatives - N,n-disubstituted p-toluenesulfonamide - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - P-toluenesulfonamide - Amphetamine or derivatives - Benzenesulfonamide - Tosyl compound - Benzenesulfonyl group - Medium-chain fatty acid - Branched fatty acid - Toluene - Monocyclic benzene moiety - Fatty amide - Organosulfonic acid amide - Fatty acyl - Fatty acid - Benzenoid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Aminosulfonyl compound - Sulfonyl - Acetamide - Secondary carboxylic acid amide - Carboxamide group - Monocarboxylic acid or derivatives - Carboxylic acid - Hydrocarbon derivative - Organic oxygen compound - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organic nitrogen compound - Organic oxide - Organosulfur compound - 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