Compound Identification
SMILES
C[C@H](O)[C@](O)(CNS(=O)(=O)C1=CC=C(C)C=C1)C(=O)OC(C)(C)C
InChIKey
InChIKey=QFAAIBKCJSDFCS-BLLLJJGKSA-N
Formula
C16H25NO6S
Mass
359.44
Taxonomic Classification
Taxonomy Tree
-
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 Beta 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
Direct Parent
Beta amino acids and derivatives
Alternative Parents
P-toluenesulfonamides Benzenesulfonamides Benzenesulfonyl compounds Beta hydroxy acids and derivatives Fatty acid esters Organosulfonamides Tertiary alcohols Aminosulfonyl compounds Carboxylic acid esters 1,2-diols Secondary alcohols Monocarboxylic acids and derivatives Hydrocarbon derivatives Organonitrogen compounds Carbonyl compounds Organic oxides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
P-toluenesulfonamide - Beta amino acid or derivatives - Benzenesulfonamide - Tosyl compound - Benzenesulfonyl group - Beta-hydroxy acid - Fatty acid ester - Toluene - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Hydroxy acid - Organosulfonic acid amide - Aminosulfonyl compound - Tertiary alcohol - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - 1,2-diol - Carboxylic acid ester - Secondary alcohol - Monocarboxylic acid or derivatives - Organooxygen compound - Organonitrogen compound - Alcohol - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Organic nitrogen compound - Organic oxygen compound - Aromatic homomonocyclic 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