Compound Identification
SMILES
CN1C=CN=C1SCCCCOC1=CC=C(OCC(=O)COC2=CC=C(C=C2)C(O)=O)C=C1
InChIKey
InChIKey=OBRFMLVYAHTMPJ-UHFFFAOYSA-N
Formula
C24H26N2O6S
Mass
470.54
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Benzoic acids and derivatives
- Level 5 Benzoic acids
-
Subclass
Benzoic acids and derivatives
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Benzoic acids
Alternative Parents
Phenoxy compounds Phenol ethers Benzoyl derivatives Imidazolyl carboxylic acids and derivatives Alkyl aryl ethers Alkylarylthioethers N-substituted imidazoles Monosaccharides Glycerone and derivatives Heteroaromatic compounds Sulfenyl compounds Azacyclic compounds Carboxylic acids Organic oxides Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzoic acid - Phenoxy compound - Aryl thioether - Benzoyl - Imidazolyl carboxylic acid derivative - Phenol ether - Alkyl aryl ether - Alkylarylthioether - Glycerone or derivatives - Monosaccharide - N-substituted imidazole - Azole - Heteroaromatic compound - Imidazole - Ketone - Carboxylic acid derivative - Carboxylic acid - Ether - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Thioether - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organic nitrogen compound - Organosulfur compound - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzoic acids. These are organic Compounds containing a benzene ring which bears at least one carboxyl group.
External Descriptors
Not available