Structure Information
Structure

Compound Identification

SMILES

CC(C)(C)OC(=O)CC(N)B(O)OC(C)(C)C(C)(C)O

InChIKey

InChIKey=GKXOQFGIRHPRQD-UHFFFAOYSA-N

Formula

C13H28BNO5

Mass

289.18

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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

Aliphatic acyclic compounds

Substituents

Beta amino acid or derivatives - Boronic acid ester - Tertiary alcohol - Boronic acid derivative - Carboxylic acid ester - Monocarboxylic acid or derivatives - Organic metalloid salt - Alcohol - Hydrocarbon derivative - Primary amine - Organooxygen compound - Organonitrogen compound - Organic metalloid moeity - Organic oxide - Primary aliphatic amine - Alkylborane - Carbonyl group - Monoalkylborane - Organic oxygen compound - Organic nitrogen compound - Amine - Aliphatic acyclic 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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