Compound Identification
SMILES
COC(=O)C(CSC(F)=CBr)NC(C)=O
InChIKey
InChIKey=SHUNLFZVSABWSW-UHFFFAOYSA-N
Formula
C8H11BrFNO3S
Mass
300.14
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
- Level 5 Amino acids and derivatives
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Subclass
Amino acids, peptides, and analogues
-
Class
Carboxylic acids and derivatives
-
Superclass
Organic acids and derivatives
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 - Alpha amino acids and derivatives
Direct Parent
N-acyl-alpha amino acids and derivatives
Alternative Parents
Alpha amino acid esters Cysteine and derivatives Acetamides Methyl esters Secondary carboxylic acid amides Vinyl fluorides Vinyl bromides Bromoalkenes Sulfenyl compounds Fluoroalkenes Monocarboxylic acids and derivatives Hydrocarbon derivatives Organonitrogen compounds Carbonyl compounds Organic oxides Organobromides Organofluorides
Molecular Framework
Aliphatic acyclic compounds
Substituents
Alpha-amino acid ester - N-acyl-alpha amino acid or derivatives - Cysteine or derivatives - Acetamide - Methyl ester - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Monocarboxylic acid or derivatives - Fluoroalkene - Vinyl bromide - Vinyl fluoride - Vinyl halide - Sulfenyl compound - Bromoalkene - Haloalkene - Organooxygen compound - Organonitrogen compound - Organofluoride - Organobromide - Organosulfur compound - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organohalogen compound - Aliphatic acyclic compound
Description
This compound belongs to the class of organic compounds known as n-acyl-alpha amino acids and derivatives. These are compounds containing an alpha amino acid (or a derivative thereof) which bears an acyl group at its terminal nitrogen atom.
External Descriptors
Not available