Compound Identification
SMILES
CC(C)(C)C1=CC(C(O)=O)=C2C(=C1)C(=O)OC2(C1=CC=CC=C1)C1=CC=CC=C1C(O)=O
InChIKey
InChIKey=CPVHTLBAPQBHQF-UHFFFAOYSA-N
Formula
C26H22O6
Mass
430.456
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Benzoic acids and derivatives
-
Level 5
Phthalic acid and derivatives
- Level 6 M-phthalic acid and derivatives
-
Level 5
Phthalic acid and derivatives
-
Subclass
Benzoic acids and derivatives
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Phthalic acid and derivatives
Direct Parent
M-phthalic acid and derivatives
Alternative Parents
Phthalides Benzofuranones Tricarboxylic acids and derivatives Benzoic acids Benzoyl derivatives Lactones Carboxylic acid esters Oxacyclic compounds Carboxylic acids Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Meta_phthalic_acid - Benzofuranone - Isobenzofuranone - Phthalide - Benzoic acid - Isocoumaran - Tricarboxylic acid or derivatives - Benzoyl - Carboxylic acid ester - Lactone - Carboxylic acid derivative - Oxacycle - Carboxylic acid - Organoheterocyclic compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as m-phthalic acid and derivatives. These are aromatic compounds containing a benzene ring bearing a carboxylic acid group at ring carbon atoms 1 and 2.
External Descriptors
Not available