Compound Identification
SMILES
CC(=O)O[C@@H]1C[C@H]2C(=O)O[C@@H](C3=COC=C3)C2=C(C)[C@H]2CCC=C3C(=O)OC[C@@]123
InChIKey
InChIKey=AAESZUTUGQRGAR-ODOVKQMBSA-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
Gamma butyrolactones Tetrahydrofurans Heteroaromatic compounds Furans Enoate esters Oxacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Tricarboxylic acid or derivatives - Gamma butyrolactone - Heteroaromatic compound - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Tetrahydrofuran - Furan - Lactone - Carboxylic acid ester - Oxacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organic oxygen compound - Organooxygen compound - Carbonyl group - Organic oxide - Aromatic heteropolycyclic 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