Compound Identification
SMILES
OC(=O)C1=C(O)C=CC(NC(=O)CN2C(=O)C[C@H](SCCNCCCCC[C@H]3CCSS3)C2=O)=C1
InChIKey
InChIKey=XZOPYNWEBJUVDW-LPHOPBHVSA-N
Formula
C23H31N3O6S3
Mass
541.7
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Acylaminobenzoic acid and derivatives
Alternative Parents
Alpha amino acids and derivatives Salicylic acids Anilides Benzoic acids Benzoyl derivatives N-arylamides 1-hydroxy-2-unsubstituted benzenoids Pyrrolidine-2-ones N-substituted carboxylic acid imides N-alkylpyrrolidines 1,2-dithiolanes Vinylogous acids Dicarboximides Organic disulfides Secondary carboxylic acid amides Amino acids Lactams Dialkylthioethers Dialkylamines Carboxylic acids Azacyclic compounds Sulfenyl compounds Carbonyl compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Acylaminobenzoic acid or derivatives - Alpha-amino acid or derivatives - Salicylic acid or derivatives - Salicylic acid - Hydroxybenzoic acid - Benzoic acid - Anilide - Benzoyl - N-arylamide - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Carboxylic acid imide, n-substituted - Pyrrolidone - 2-pyrrolidone - N-alkylpyrrolidine - Pyrrolidine - Carboxylic acid imide - Vinylogous acid - Dicarboximide - 1,2-dithiolane - Dithiolane - Amino acid - Organic disulfide - Lactam - Secondary carboxylic acid amide - Carboxamide group - Amino acid or derivatives - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Carboxylic acid - Secondary aliphatic amine - Dialkylthioether - Sulfenyl compound - Thioether - Secondary amine - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organic nitrogen compound - Amine - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as acylaminobenzoic acid and derivatives. These are derivatives of amino benzoic acid derivatives where the amine group is N-acylated.
External Descriptors
Not available