Compound Identification
SMILES
Cl.NCC(O)=O.CS(=O)(=O)C1=CC=C(C=C1)[C@@H](O)[C@@H](CO)NC(=O)C(Cl)Cl
InChIKey
InChIKey=DCHDXAKWPVJOGN-HSTMFJOWSA-N
Formula
C14H21Cl3N2O7S
Mass
467.74
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 Alpha amino acids
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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
Direct Parent
Alpha amino acids
Alternative Parents
Benzenesulfonyl compounds Sulfones Secondary carboxylic acid amides Secondary alcohols Amino acids Carboxylic acids Monocarboxylic acids and derivatives Organic oxides Monoalkylamines Hydrochlorides Hydrocarbon derivatives Organochlorides Carbonyl compounds Organopnictogen compounds Aromatic alcohols Primary alcohols Alkyl chlorides
Molecular Framework
Not available
Substituents
Alpha-amino acid - Benzenesulfonyl group - Monocyclic benzene moiety - Benzenoid - Sulfone - Sulfonyl - Carboxamide group - Secondary alcohol - Secondary carboxylic acid amide - Amino acid - Carboxylic acid - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Alkyl halide - Alkyl chloride - Primary amine - Primary alcohol - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organopnictogen compound - Primary aliphatic amine - Organic oxide - Alcohol - Carbonyl group - Organic oxygen compound - Amine - Aromatic alcohol - Organic nitrogen compound - Hydrochloride - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as alpha amino acids. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon).
External Descriptors
Not available