Compound Identification
SMILES
[Na+].[Na+].CCC(CC(CC(C)(C)C(=O)OCCOC(=O)CC([O-])=O)C(=O)NC(C)(C)CS(O)(=O)=O)C1=CC=C(C=C1)S([O-])(=O)=O
InChIKey
InChIKey=BPWHXIGGBPDIMV-UHFFFAOYSA-L
Formula
C26H37NNa2O13S2
Mass
681.68
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzenesulfonic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Benzenesulfonic acids and derivatives
Alternative Parents
Tricarboxylic acids and derivatives Phenylpropanes 1-sulfo,2-unsubstituted aromatic compounds Benzenesulfonyl compounds Fatty acid esters 1,3-dicarbonyl compounds N-acyl amines Sulfonyls Organosulfonic acids Alkanesulfonic acids Secondary carboxylic acid amides Carboxylic acid esters Carboxylic acid salts Carboxylic acids Organic sodium salts Organonitrogen compounds Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Benzenesulfonate - Arylsulfonic acid or derivatives - Benzenesulfonyl group - Phenylpropane - Tricarboxylic acid or derivatives - 1-sulfo,2-unsubstituted aromatic compound - Fatty acid ester - Fatty amide - N-acyl-amine - Fatty acyl - 1,3-dicarbonyl compound - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Alkanesulfonic acid - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Carboxylic acid salt - Carboxylic acid derivative - Organic alkali metal salt - Carboxylic acid - Carbonyl group - Organic salt - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Organic sodium salt - Organic cation - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzenesulfonic acids and derivatives. These are organic compounds containing a sulfonic acid or a derivative thereof that is linked to a benzene ring.
External Descriptors
Not available