Compound Identification
SMILES
COC(=O)[C@H](CCCCNC(=S)[C@H](CC1=CNC2=CC=CC=C12)NS(=O)(=O)C1=CC=C(C)C=C1)N(CC(C)C)S(=O)(=O)C1=CC=C(C)C=C1
InChIKey
InChIKey=IXXRVACKVUAYPD-HEVIKAOCSA-N
Formula
C36H46N4O6S3
Mass
726.97
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 Alpha amino acid esters
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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
Alpha amino acid esters
Alternative Parents
N,N-disubstituted p-toluenesulfonamides Tryptamines and derivatives 3-alkylindoles Benzenesulfonamides Benzenesulfonyl compounds Fatty acid esters Substituted pyrroles Organosulfonamides Aminosulfonyl compounds Thioamides Methyl esters Heteroaromatic compounds Thiocarboxylic acid amides Azacyclic compounds Monocarboxylic acids and derivatives Organic oxides Organonitrogen compounds Carbonyl compounds Thiocarbonyl compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid ester - N,n-disubstituted p-toluenesulfonamide - Triptan - P-toluenesulfonamide - Benzenesulfonamide - Tosyl compound - 3-alkylindole - Indole or derivatives - Benzenesulfonyl group - Indole - Fatty acid ester - Toluene - Monocyclic benzene moiety - Substituted pyrrole - Organosulfonic acid amide - Fatty acyl - Benzenoid - Heteroaromatic compound - Thioamide - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Pyrrole - Aminosulfonyl compound - Methyl ester - Carboxylic acid ester - Azacycle - Thiocarboxylic acid amide - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Thiocarbonyl group - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as alpha amino acid esters. These are ester derivatives of alpha amino acids.
External Descriptors
Not available