Compound Identification
SMILES
CCC(C)C(N1C(=O)C2=CC=CC=C2C1=O)C(=O)NC1=NC2=C(S1)C=C(C=C2)S(N)(=O)=O
InChIKey
InChIKey=LCEJMVHMFLRKGB-UHFFFAOYSA-N
Formula
C21H20N4O5S2
Mass
472.53
Taxonomic Classification
Taxonomy Tree
-
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
-
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
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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
Isoleucine and derivatives
Alternative Parents
Phthalimides Benzothiazoles Isoindoles N-arylamides Benzenoids Fatty amides Organosulfonamides N-substituted carboxylic acid imides Heteroaromatic compounds Aminosulfonyl compounds Thiazoles Secondary carboxylic acid amides Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoleucine or derivatives - Phthalimide - Isoindolone - 1,3-benzothiazole - Isoindoline - Isoindole - Isoindole or derivatives - N-arylamide - Fatty amide - Carboxylic acid imide, n-substituted - Organosulfonic acid amide - Benzenoid - Fatty acyl - Aminosulfonyl compound - Carboxylic acid imide - Heteroaromatic compound - Azole - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Thiazole - Secondary carboxylic acid amide - Carboxamide group - Azacycle - Organoheterocyclic compound - Organonitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Organic oxygen compound - Aromatic heteropolycyclic 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