Compound Identification
SMILES
OC(=O)[C@@]1(CCC(=O)O1)N1OC[C@H](NC(=O)CS(=O)(=O)C=C(Cl)Cl)C1=O
InChIKey
InChIKey=BLANQIRVBIZURB-QTTZVWFDSA-N
Formula
C12H12Cl2N2O9S
Mass
431.19
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
Oxazolidinones Dicarboxylic acids and derivatives Gamma butyrolactones Sulfones Oxolanes Isoxazolidines Carboxylic acid esters Secondary carboxylic acid amides Azacyclic compounds Vinyl chlorides Carboxylic acids Chloroalkenes Oxacyclic compounds Carbonyl compounds Organonitrogen compounds Hydrocarbon derivatives Organochlorides Organic oxides
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
N-acyl-alpha amino acid or derivatives - Dicarboxylic acid or derivatives - Gamma butyrolactone - Oxazolidinone - Isoxazolidine - Oxolane - Sulfone - Sulfonyl - Carboxylic acid ester - Carboxamide group - Secondary carboxylic acid amide - Lactone - Organoheterocyclic compound - Vinyl halide - Vinyl chloride - Oxacycle - Azacycle - Chloroalkene - Haloalkene - Carboxylic acid - Carbonyl group - Organohalogen compound - Organic oxide - Organochloride - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Aliphatic heteromonocyclic 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