Compound Identification
SMILES
CC(N1C(=O)C2CC=CCC2C1=O)C(=O)OCC(=O)NC1=C(C(N)=O)C2=C(CCC2)S1
InChIKey
InChIKey=WVSPWMWPUAORGY-UHFFFAOYSA-N
Formula
C21H23N3O6S
Mass
445.49
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
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Level 5
Amino acids and derivatives
-
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
Indolyl carboxylic acids and derivatives Alanine and derivatives Isoindolones Indoles Isoindoles Thiophene carboxamides N-arylamides Pyrrolidine-2-ones N-substituted carboxylic acid imides N-alkylpyrrolidines Vinylogous amides Dicarboximides Heteroaromatic compounds Secondary carboxylic acid amides Carboxylic acid esters Primary carboxylic acid amides Lactams Monocarboxylic acids and derivatives Azacyclic compounds Carbonyl compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid ester - Indolyl carboxylic acid derivative - Alanine or derivatives - Isoindolone - Indole - Isoindoline - Isoindole - Isoindole or derivatives - Thiophene carboxamide - Thiophene carboxylic acid or derivatives - N-arylamide - Carboxylic acid imide, n-substituted - Pyrrolidone - 2-pyrrolidone - N-alkylpyrrolidine - Thiophene - Pyrrolidine - Vinylogous amide - Carboxylic acid imide - Dicarboximide - Heteroaromatic compound - Carboxamide group - Primary carboxylic acid amide - Secondary carboxylic acid amide - Carboxylic acid ester - Lactam - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Azacycle - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Organonitrogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen 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