Compound Identification
SMILES
CC[C@@H](COC(=O)CCC([O-])=O)NC1=NC=C(C)C(=N1)C1=CNC(=C1)C(=O)N[C@H](COC(=O)CCC([O-])=O)C1=CC(Cl)=CC=C1
InChIKey
InChIKey=IDMUQRIKBGJNAV-JTHBVZDNSA-L
Formula
C30H32ClN5O9
Mass
642.06
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
Pyrrole carboxamides 2-heteroaryl carboxamides Aminopyrimidines and derivatives Fatty acid esters Chlorobenzenes Substituted pyrroles Aryl chlorides Heteroaromatic compounds Secondary carboxylic acid amides Carboxylic acid esters Carboxylic acid salts Azacyclic compounds Carboxylic acids Carbonyl compounds Organochlorides Organic oxides Hydrocarbon derivatives Amines Organic anions
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Tetracarboxylic acid or derivatives - 2-heteroaryl carboxamide - Pyrrole-2-carboxamide - Pyrrole-2-carboxylic acid or derivatives - Aminopyrimidine - Halobenzene - Chlorobenzene - Fatty acid ester - Aryl chloride - Aryl halide - Fatty acyl - Benzenoid - Monocyclic benzene moiety - Substituted pyrrole - Pyrimidine - Pyrrole - Heteroaromatic compound - Carboxamide group - Carboxylic acid ester - Carboxylic acid salt - Secondary carboxylic acid amide - Organoheterocyclic compound - Azacycle - Carboxylic acid - Organohalogen compound - Organic nitrogen compound - Amine - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organochloride - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - 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