Compound Identification
SMILES
CCOC(=O)C1SC(SC)=C(N2C=CC(C)=CC12)C(=O)OCC
InChIKey
InChIKey=HHBJSZHDKVLSMH-UHFFFAOYSA-N
Formula
C16H21NO4S2
Mass
355.47
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
Dihydropyridines Vinylogous thioesters Dicarboxylic acids and derivatives 1,4-thiazines Enoate esters Trialkylamines Sulfenyl compounds Enamines Azacyclic compounds Allylamines Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - Dihydropyridine - Para-thiazine - Dicarboxylic acid or derivatives - Vinylogous thioester - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Carboxylic acid ester - Tertiary amine - Tertiary aliphatic amine - Sulfenyl compound - Allylamine - Enamine - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic oxide - Carbonyl group - Amine - Organic nitrogen compound - Aliphatic 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