Compound Identification
SMILES
OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)S(CC([O-])=O)(CC([O-])=O)(CC([O-])=O)(CC([O-])=O)CC1=CC=CC=C1
InChIKey
InChIKey=QHUAUXRZTKMGHS-LLUPQEGFSA-J
Formula
C21H26O13S
Mass
518.49
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
Tetracarboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Tetracarboxylic acids and derivatives
Alternative Parents
Hexoses Thiodiacetic acid derivatives Oxanes Benzene and substituted derivatives Monothioacetals Secondary alcohols Carboxylic acid salts Polyols Oxacyclic compounds Carboxylic acids Primary alcohols Organic oxides Hydrocarbon derivatives Carbonyl compounds Organic anions
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Tetracarboxylic acid or derivatives - Hexose monosaccharide - Thiodiacetic_acid - Monocyclic benzene moiety - Monosaccharide - Oxane - Benzenoid - Monothioacetal - Carboxylic acid salt - Secondary alcohol - Polyol - Carboxylic acid - Oxacycle - Organoheterocyclic compound - Primary alcohol - Alcohol - Organosulfur compound - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Organic oxide - Organic anion - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as tetracarboxylic acids and derivatives. These are carboxylic acids containing exactly four carboxyl groups.
External Descriptors
Not available