Compound Identification
SMILES
COC(=O)C1=C\C(=C\NN(CCC(=O)NC(C)(C)C)C2=NS(=O)(=O)C3=CC=CC=C23)C(=O)C=C1
InChIKey
InChIKey=LIQMEVSRNILXAB-PEZBUJJGSA-N
Formula
C23H26N4O6S
Mass
486.54
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
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Level 5
Amino acids and derivatives
- Level 6 Beta amino acids and derivatives
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Level 5
Amino acids and derivatives
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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
Direct Parent
Beta amino acids and derivatives
Alternative Parents
Benzothiazoles O-quinomethanes Imidolactams Benzenoids Vinylogous amides Organosulfonic acids and derivatives Methyl esters Enoate esters Secondary carboxylic acid amides Amidrazones Monocarboxylic acids and derivatives Azacyclic compounds Amidines Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Beta amino acid or derivatives - 1,2-benzothiazole - O-quinomethane - Quinomethane - Benzenoid - Imidolactam - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Methyl ester - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Vinylogous amide - Carboxylic acid amidrazone - Secondary carboxylic acid amide - Cyclic ketone - Carboxamide group - Carboxylic acid ester - Ketone - Organoheterocyclic compound - Amidine - Azacycle - Monocarboxylic acid or derivatives - Carbonyl group - Organic oxide - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as beta amino acids and derivatives. These are amino acids having a (-NH2) group attached to the beta carbon atom.
External Descriptors
Not available