Structure Information
Structure

Compound Identification

SMILES

CCCCCCCCCCCCNC(=O)CCNC1=CC(O)=C(Cl)C=C1SC1=CC=CC=C1

InChIKey

InChIKey=GZTZHOVTOUFKRR-UHFFFAOYSA-N

Formula

C27H39ClN2O2S

Mass

491.13

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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 homomonocyclic compounds

Substituents

Beta amino acid or derivatives - Diarylthioether - Aminophenol - M-aminophenol - Aryl thioether - 2-halophenol - 2-chlorophenol - Thiophenol ether - Phenylalkylamine - Aniline or substituted anilines - 1-hydroxy-2-unsubstituted benzenoid - Chlorobenzene - Halobenzene - Phenol - Secondary aliphatic/aromatic amine - Aryl halide - Aryl chloride - Benzenoid - Monocyclic benzene moiety - Secondary carboxylic acid amide - Carboxamide group - Secondary amine - Sulfenyl compound - Thioether - Organosulfur compound - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Carbonyl group - Amine - Organohalogen compound - Organochloride - Organonitrogen compound - Hydrocarbon derivative - Organooxygen compound - Aromatic homomonocyclic 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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