Compound Identification
SMILES
OC(=O)CC(O)(CC(O)=O)C(O)=O.OC(CN1CCCCC1)C1=NOC(=C1)C1=CC=CC=C1
InChIKey
InChIKey=LLIFHVXJAXBPMC-UHFFFAOYSA-N
Formula
C22H28N2O9
Mass
464.471
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
Aralkylamines Piperidines Alpha hydroxy acids and derivatives Benzene and substituted derivatives Tertiary alcohols Isoxazoles Heteroaromatic compounds Trialkylamines Secondary alcohols 1,2-aminoalcohols Oxacyclic compounds Azacyclic compounds Carboxylic acids Organopnictogen compounds Aromatic alcohols Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Not available
Substituents
Tricarboxylic acid or derivatives - Aralkylamine - Alpha-hydroxy acid - Monocyclic benzene moiety - Hydroxy acid - Piperidine - Benzenoid - Azole - Isoxazole - Tertiary alcohol - Heteroaromatic compound - Tertiary aliphatic amine - Tertiary amine - Secondary alcohol - 1,2-aminoalcohol - Azacycle - Oxacycle - Organoheterocyclic compound - Carboxylic acid - Aromatic alcohol - Organonitrogen compound - Alcohol - Organopnictogen compound - Organooxygen compound - Carbonyl group - Organic oxygen compound - Organic oxide - Amine - Organic nitrogen compound - Hydrocarbon derivative - 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