Compound Identification
SMILES
N[C@H](CSCC1CCCCC1)[C@H](O)C(=O)NCCC1=C(Cl)C=C(Cl)C=C1
InChIKey
InChIKey=PCYWWZYLMGJJJD-MSOLQXFVSA-N
Formula
C19H28Cl2N2O2S
Mass
419.41
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
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Level 5
Amino acids and derivatives
- Level 6 Beta amino acids and derivatives
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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
Direct Parent
Beta amino acids and derivatives
Alternative Parents
Dichlorobenzenes N-acyl amines Monosaccharides Aryl chlorides Secondary carboxylic acid amides Secondary alcohols Sulfenyl compounds Dialkylthioethers Organochlorides Organic oxides Monoalkylamines Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Beta amino acid or derivatives - 1,3-dichlorobenzene - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Fatty amide - Monosaccharide - N-acyl-amine - Carboxamide group - Secondary carboxylic acid amide - Secondary alcohol - Dialkylthioether - Sulfenyl compound - Thioether - Organooxygen compound - Primary aliphatic amine - Organosulfur compound - Primary amine - Amine - Alcohol - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organohalogen compound - Organochloride - 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