Compound Identification
SMILES
CCCCC1(C)OC(=O)C(=CC2=CC=C(O2)C2=C(C)C=CC(=C2)C(O)=O)C(=O)O1
InChIKey
InChIKey=UNPHRBXNIYLJTI-UHFFFAOYSA-N
Formula
C22H22O7
Mass
398.411
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
Benzoic acids Benzoyl derivatives Toluenes Ketals 1,3-dioxanes Heteroaromatic compounds Furans Enoate esters Lactones Oxacyclic compounds Carboxylic acids Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzoic acid or derivatives - Benzoic acid - Tricarboxylic acid or derivatives - Benzoyl - Ketal - Toluene - Meta-dioxane - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Furan - Carboxylic acid ester - Lactone - Acetal - Oxacycle - Organoheterocyclic compound - Carboxylic acid - Organic oxygen compound - Hydrocarbon derivative - Carbonyl group - Organooxygen compound - Organic oxide - Aromatic heteromonocyclic 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