Structure Information
Structure

Compound Identification

SMILES

CCOCOCC(CC(CC#C)C(O)=O)NC(=O)C1=CC=C(Br)C=C1

InChIKey

InChIKey=IFIQBZOKETZOTD-UHFFFAOYSA-N

Formula

C18H22BrNO5

Mass

412.28

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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

Gamma amino acids and derivatives

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Gamma amino acid or derivatives - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzamide - Benzoic acid or derivatives - Benzoyl - Bromobenzene - Halobenzene - Benzenoid - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Secondary carboxylic acid amide - Carboxamide group - Acetylide - Acetal - Carboxylic acid - Monocarboxylic acid or derivatives - Organobromide - Carbonyl group - Organonitrogen compound - Organic oxygen compound - Organooxygen compound - Organic nitrogen compound - Organic oxide - Organopnictogen compound - Organohalogen compound - Hydrocarbon derivative - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as gamma amino acids and derivatives. These are amino acids having a (-NH2) group attached to the gamma carbon atom.

External Descriptors

Not available

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