Compound Identification
SMILES
COC1=CC=C(C=C1)C#CC1=CC=C(C=C1)S(=O)(=O)C(N)(CC(O)CSC1=NC=CS1)C(O)=O
InChIKey
InChIKey=JFFFVLOIHDEOGF-UHFFFAOYSA-N
Formula
C23H22N2O6S3
Mass
518.62
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
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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
Benzenesulfonyl compounds Phenoxy compounds Anisoles Methoxybenzenes Thia fatty acids Alkyl aryl ethers Alkylarylthioethers Hydroxy fatty acids Thiazoles Sulfones Heteroaromatic compounds Secondary alcohols Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Sulfenyl compounds Carbonyl compounds Organic oxides Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-amino acid or derivatives - Benzenesulfonyl group - Phenoxy compound - Aryl thioether - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Hydroxy fatty acid - Thia fatty acid - Alkylarylthioether - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Azole - Heteroaromatic compound - Sulfone - Sulfonyl - Thiazole - Secondary alcohol - Sulfenyl compound - Azacycle - Thioether - Organoheterocyclic compound - Carboxylic acid - Monocarboxylic acid or derivatives - Ether - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Carbonyl group - Hydrocarbon derivative - Alcohol - Organic oxide - Organooxygen compound - Organosulfur compound - Aromatic 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