Structure Information
Structure

Compound Identification

SMILES

COC(=O)[C@@H](OCC1=CC=CC=C1)[C@@H](COS(C)(=O)=O)NOC1=CC=C(OC)C=C1

InChIKey

InChIKey=VNRXAXHEYVSMFC-MOPGFXCFSA-N

Formula

C20H25NO8S

Mass

439.48

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Taxonomic Classification

Taxonomy Tree

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

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Beta amino acid or derivatives - N-alkyl-o-phenylhydroxylamine - Benzylether - Phenoxy compound - O-phenylhydroxylamine - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - Fatty acid ester - Monocyclic benzene moiety - Monosaccharide - Fatty acyl - Sulfonic acid ester - Organosulfonic acid ester - Benzenoid - Organic sulfonic acid or derivatives - Methyl ester - Sulfonyl - Organosulfonic acid or derivatives - Methanesulfonate - Carboxylic acid ester - Dialkyl ether - Ether - N-organohydroxylamine - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organonitrogen compound - Carbonyl group - Organic nitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Organic oxide - 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

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