Compound Identification
SMILES
CON1C(=O)[C@@H](NC(=O)[C@@]11OC2=CC(O)=C(Cl)C=C2[C@@H]1SC(C)=O)SC(C)=O
InChIKey
InChIKey=VTQLCOLNVKTAES-HEHGZKQESA-N
Formula
C16H15ClN2O7S2
Mass
446.87
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
Direct Parent
Alpha amino acids and derivatives
Alternative Parents
Thiodioxopiperazines Benzofurans Coumarans Halophenols 1-hydroxy-2-unsubstituted benzenoids Aryl chlorides Thioesters Secondary carboxylic acid amides Carbothioic S-esters Lactams Thiohemiaminal derivatives Sulfenyl compounds Azacyclic compounds Oxacyclic compounds Carbonyl compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - Coumaran - Benzofuran - Thiodioxopiperazine - Dioxopiperazine - 2-halophenol - 2,5-dioxopiperazine - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Aryl chloride - Aryl halide - 1,4-diazinane - Benzenoid - Piperazine - Carboxamide group - Lactam - Carbothioic s-ester - Secondary carboxylic acid amide - Thiocarboxylic acid ester - Hemithioaminal - Thiocarboxylic acid or derivatives - Sulfenyl compound - Oxacycle - Azacycle - Organoheterocyclic compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as alpha amino acids and derivatives. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon), or a derivative thereof.
External Descriptors
Not available