Compound Identification
SMILES
COC(=O)C=C1NCCSC1=O
InChIKey
InChIKey=YIWWALWBXPPQNQ-UHFFFAOYSA-N
Formula
C7H9NO3S
Mass
187.21
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
Thiomorpholines Vinylogous amides Methyl esters Enoate esters Carbothioic S-lactones Thioesters Monocarboxylic acids and derivatives Enamines Dialkylamines Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
Alpha-amino acid or derivatives - 1,4-thiazinane - Methyl ester - Enoate ester - Vinylogous amide - Carbothioic s-lactone - Alpha,beta-unsaturated carboxylic ester - Carboxylic acid ester - Thiocarboxylic acid ester - Secondary aliphatic amine - Enamine - Monocarboxylic acid or derivatives - Thiocarboxylic acid or derivatives - Azacycle - Organoheterocyclic compound - Organonitrogen compound - Amine - Organic nitrogen compound - Organooxygen compound - Carbonyl group - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Aliphatic heteromonocyclic 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