Compound Identification
SMILES
CCC(C)[C@H](NC[C@@H](N)CS)C(=O)N[C@H](CN[C@@H](CCSC)C(O)=O)CC1=CC=CC=C1
InChIKey
InChIKey=XEDXTEZWILWFIY-UQRQBEMFSA-N
Formula
C23H40N4O3S2
Mass
484.72
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 Isoleucine and derivatives
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Level 6
Alpha amino acids and derivatives
-
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
Isoleucine and derivatives
Alternative Parents
Methionine and derivatives Alpha amino acid amides Amphetamines and derivatives L-alpha-amino acids Thia fatty acids Aralkylamines N-acyl amines Secondary carboxylic acid amides Amino acids Alkylthiols Sulfenyl compounds Monocarboxylic acids and derivatives Carboxylic acids Dialkylthioethers Dialkylamines Organic oxides Monoalkylamines Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Isoleucine or derivatives - Methionine or derivatives - Alpha-amino acid amide - Alpha-amino acid - Amphetamine or derivatives - L-alpha-amino acid - Aralkylamine - Thia fatty acid - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Fatty amide - N-acyl-amine - Amino acid - Carboxamide group - Secondary carboxylic acid amide - Alkylthiol - Dialkylthioether - Carboxylic acid - Secondary aliphatic amine - Sulfenyl compound - Monocarboxylic acid or derivatives - Thioether - Secondary amine - Organic oxide - Amine - Organic oxygen compound - Organic nitrogen compound - Primary aliphatic amine - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Primary amine - Carbonyl group - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as isoleucine and derivatives. These are compounds containing isoleucine or a derivative thereof resulting from reaction of isoleucine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
External Descriptors
Not available