Compound Identification
SMILES
CC1=CC=CC(C)=C1OCCSC1=NC2=CC=CC=C2N1CC([O-])=O
InChIKey
InChIKey=ZAHFRMHMWCBLOL-UHFFFAOYSA-M
Formula
C19H19N2O3S
Mass
355.43
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
Benzimidazoles m-Xylenes Phenoxy compounds Phenol ethers Alkyl aryl ethers Alkylarylthioethers N-substituted imidazoles Heteroaromatic compounds Carboxylic acid salts Sulfenyl compounds Azacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Organonitrogen compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic anions
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - Benzimidazole - Phenoxy compound - Aryl thioether - M-xylene - Xylene - Phenol ether - Alkyl aryl ether - Alkylarylthioether - Monocyclic benzene moiety - N-substituted imidazole - Benzenoid - Azole - Imidazole - Heteroaromatic compound - Carboxylic acid salt - Thioether - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Carboxylic acid - Monocarboxylic acid or derivatives - Ether - Organosulfur compound - Organooxygen compound - Organic oxygen compound - Organonitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organic anion - 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