Compound Identification
SMILES
CCCCCCCCCCCCCC(=O)SCC(=O)N(CC(O)=O)C1=C(C)C=CC(Br)=C1C
InChIKey
InChIKey=GRWMJSJGKKWUFV-UHFFFAOYSA-N
Formula
C26H40BrNO4S
Mass
542.57
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
-
Level 6
Alpha amino acids and derivatives
-
Level 7
N-acyl-alpha amino acids and derivatives
- Level 8 N-acyl-alpha amino acids
-
Level 7
N-acyl-alpha amino acids and derivatives
-
Level 6
Alpha amino acids and derivatives
-
Level 5
Amino acids and derivatives
-
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 - N-acyl-alpha amino acids and derivatives
Direct Parent
N-acyl-alpha amino acids
Alternative Parents
Anilides m-Xylenes Bromobenzenes Fatty acyl thioesters Aryl bromides Tertiary carboxylic acid amides Thioesters Carbothioic S-esters Sulfenyl compounds Carboxylic acids Monocarboxylic acids and derivatives Organic oxides Carbonyl compounds Organonitrogen compounds Organobromides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
N-acyl-alpha-amino acid - Anilide - M-xylene - Xylene - Bromobenzene - Fatty acyl thioester - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Tertiary carboxylic acid amide - Carbothioic s-ester - Carboxamide group - Thiocarboxylic acid ester - Sulfenyl compound - Carboxylic acid - Thiocarboxylic acid or derivatives - Monocarboxylic acid or derivatives - Organosulfur compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as n-acyl-alpha amino acids. These are compounds containing an alpha amino acid which bears an acyl group at its terminal nitrogen atom.
External Descriptors
Not available