Compound Identification
SMILES
C[C@H]1C(=O)O[C@H]2[C@@H](Cl)C(=C)[C@]3(O)C[C@H](OC(C)=O)[C@@]4(C)[C@H](C[C@@H](OC(=O)C5=CC=CC=C5)[C@H](C)[C@@H]4[C@H](OC(C)=O)[C@]12O3)OC(C)=O
InChIKey
InChIKey=BNGBLGMXQIGBTE-RNHGDPAHSA-N
Formula
C33H39ClO12
Mass
663.11
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
Pentacarboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Pentacarboxylic acids and derivatives
Alternative Parents
Benzoic acid esters Furopyrans Benzoyl derivatives Pyrans Oxanes Gamma butyrolactones Tetrahydrofurans Furans Carboxylic acid esters Hemiacetals Oxacyclic compounds Organic oxides Alkyl chlorides Carbonyl compounds Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pentacarboxylic acid or derivatives - Benzoate ester - Benzoic acid or derivatives - Furopyran - Benzoyl - Monocyclic benzene moiety - Gamma butyrolactone - Oxane - Pyran - Benzenoid - Tetrahydrofuran - Furan - Carboxylic acid ester - Hemiacetal - Lactone - Oxacycle - Organoheterocyclic compound - Alkyl halide - Organochloride - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Alkyl chloride - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pentacarboxylic acids and derivatives. These are carboxylic acids containing exactly five carboxyl groups.
External Descriptors
Not available