Compound Identification
SMILES
CC[C@H](C)[C@H](N1CCN(CC2=CSC(=N2)C2=CN=CC=C2)C1=O)C(=O)N[C@@H](CC1=CC=CC=C1)[C@@H](O)CN(CC1CCCC1)S(=O)(=O)C1=CC=C(OC)C=C1
InChIKey
InChIKey=CEVCBNTUXHZDOU-YPDOTJACSA-N
Formula
C41H52N6O6S2
Mass
789.02
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
Phenylbutylamines Amphetamines and derivatives Benzenesulfonamides Benzenesulfonyl compounds Anisoles Phenoxy compounds Methoxybenzenes 2,4-disubstituted thiazoles Alkyl aryl ethers Pyridines and derivatives Organosulfonamides Imidazolidinones N-acyl amines Heteroaromatic compounds Aminosulfonyl compounds Secondary carboxylic acid amides Ureas Secondary alcohols Azacyclic compounds Carbonyl compounds Organonitrogen compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Isoleucine or derivatives - Phenylbutylamine - Benzenesulfonamide - Amphetamine or derivatives - Benzenesulfonyl group - Anisole - Methoxybenzene - Phenol ether - Phenoxy compound - 2,4-disubstituted 1,3-thiazole - Alkyl aryl ether - Fatty amide - N-acyl-amine - Imidazolidinone - Fatty acyl - Monocyclic benzene moiety - Benzenoid - Pyridine - Organosulfonic acid amide - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Imidazolidine - Sulfonyl - Thiazole - Aminosulfonyl compound - Azole - Heteroaromatic compound - Urea - Carboxamide group - Secondary carboxylic acid amide - Secondary alcohol - Ether - Organoheterocyclic compound - Azacycle - Organic oxygen compound - Alcohol - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Aromatic heteromonocyclic 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