Compound Identification
SMILES
CC(=O)O[C@H]1[C@@H](C[C@@](COCC2=CC=CC=C2)(OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OCC1=CC=CC=C1)OS(C)(=O)=O
InChIKey
InChIKey=IVXVHBCPHUGBIP-VFHRMQJUSA-N
Formula
C28H34O11S
Mass
578.63
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Carboxylic acids and derivatives
Subclass
Tricarboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Tricarboxylic acids and derivatives
Alternative Parents
Benzylethers Sulfonic acid esters Organosulfonic acid esters Cyclitols and derivatives Sulfonyls Methanesulfonates Carboxylic acid esters Dialkyl ethers Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Benzylether - Tricarboxylic acid or derivatives - Cyclitol or derivatives - Monocyclic benzene moiety - Benzenoid - Organosulfonic acid ester - Sulfonic acid ester - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Methanesulfonate - Carboxylic acid ester - Ether - Dialkyl ether - Organosulfur compound - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as tricarboxylic acids and derivatives. These are carboxylic acids containing exactly three carboxyl groups.
External Descriptors
Not available