Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)[C@H](O)[C@@H](NC(=O)C1=CC=CC=C1)[C@H]1COC2(CCCCC2)O1

InChIKey

InChIKey=IDAICONIAHIPRN-IXDOHACOSA-N

Formula

C20H27NO6

Mass

377.437

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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 heteropolycyclic compounds

Substituents

Beta amino acid or derivatives - Benzamide - Benzoic acid or derivatives - Benzoyl - Ketal - Fatty acid ester - Monocyclic benzene moiety - Monosaccharide - Benzenoid - Fatty acyl - Meta-dioxolane - Secondary carboxylic acid amide - Secondary alcohol - Carboxylic acid ester - Carboxamide group - Oxacycle - Organoheterocyclic compound - Acetal - Monocarboxylic acid or derivatives - Organooxygen compound - Carbonyl group - Organic oxide - Organopnictogen compound - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Alcohol - Organonitrogen compound - 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

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