Structure Information
Structure

Compound Identification

SMILES

COC(=O)CCCC[C@H]1SC[C@@H]([C@H]1Br)N(CC1=CC=CC=C1)C(=O)N=[N+]=[N-]

InChIKey

InChIKey=DBZJVCCYAWHVTD-ZMSDIMECSA-N

Formula

C18H23BrN4O3S

Mass

455.37

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Fatty Acyls

Subclass

Fatty acid esters

Intermediate Tree Nodes

Not available

Direct Parent

Fatty acid methyl esters

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Fatty acid methyl ester - Monocyclic benzene moiety - Benzenoid - Methyl ester - Thiolane - Azo compound - Azo imide - Carboxylic acid ester - Carboxylic acid derivative - Organoheterocyclic compound - Dialkylthioether - Monocarboxylic acid or derivatives - Thioether - Alkyl bromide - Alkyl halide - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Organic salt - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organic cation - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as fatty acid methyl esters. These are compounds containing a fatty acid that is esterified with a methyl group. They have the general structure RC(=O)OR', where R=fatty aliphatic tail or organyl group and R'=methyl group.

External Descriptors

Not available

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