Structure Information
Structure

Compound Identification

SMILES

C[C@@H](NC(=O)OC(C)(C)C)C(=O)C(C(O)=O)C1=CC=C(O)C=C1

InChIKey

InChIKey=RBTKVEHWMOPRSE-PKEIRNPWSA-N

Formula

C16H21NO6

Mass

323.345

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic acids and derivatives

Class

Keto acids and derivatives

Subclass

Beta-keto acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Beta-keto acids and derivatives

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

1-hydroxy-2-unsubstituted benzenoid - Beta-keto acid - Phenol - Monocyclic benzene moiety - Beta-hydroxy ketone - Benzenoid - 1,3-dicarbonyl compound - Carbamic acid ester - Ketone - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic oxygen compound - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as beta-keto acids and derivatives. These are organic compounds containing an aldehyde substituted with a keto group on the C3 carbon atom.

External Descriptors

Not available

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