Structure Information
Structure

Compound Identification

SMILES

COC1=CC=C(NC2=CC(C)(OC2=O)C(O)=O)C=C1

InChIKey

InChIKey=DXPPYSXVFNEBBV-UHFFFAOYSA-N

Formula

C13H13NO5

Mass

263.249

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic oxygen compounds

Class

Organooxygen compounds

Subclass

Carbohydrates and carbohydrate conjugates

Intermediate Tree Nodes

Sugar acids and derivatives - Sugar amino acids and derivatives

Direct Parent

Furanoid amino acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Furanoid amino acid - Alpha-amino acid or derivatives - Aminophenyl ether - Methoxyaniline - Phenoxy compound - Phenol ether - Aniline or substituted anilines - Anisole - Methoxybenzene - Alkyl aryl ether - Secondary aliphatic/aromatic amine - 2-furanone - Benzenoid - Dicarboxylic acid or derivatives - Monocyclic benzene moiety - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Dihydrofuran - Carboxylic acid ester - Amino acid or derivatives - Lactone - Amino acid - Oxacycle - Organoheterocyclic compound - Carboxylic acid derivative - Secondary amine - Carboxylic acid - Ether - Enamine - Organopnictogen compound - Carbonyl group - Amine - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Organic nitrogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as furanoid amino acids and derivatives. These are sugar amino acids containing a furan ring.

External Descriptors

Not available

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