Compound Identification
SMILES
CCOC(=O)C(=CNC1CC(CC(C1)NC=C(C(C)=O)C(=O)OCC)NC=C(C(C)=O)C(=O)OCC)C(C)=O
InChIKey
InChIKey=JKRWYYDDQLRGDS-UHFFFAOYSA-N
Formula
C27H39N3O9
Mass
549.621
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
Fatty acid esters Cyclohexylamines Beta-keto acids and derivatives Alpha-branched alpha,beta-unsaturated ketones Vinylogous amides Enones Enoate esters Acryloyl compounds Ketones Enamines Dialkylamines Allylamines Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic homomonocyclic compounds
Substituents
Tricarboxylic acid or derivatives - Beta-keto acid - Cyclohexylamine - Fatty acid ester - Keto acid - Alpha-branched alpha,beta-unsaturated-ketone - Fatty acyl - Vinylogous amide - Alpha,beta-unsaturated ketone - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Enone - Acryloyl-group - Carboxylic acid ester - Ketone - Allylamine - Secondary aliphatic amine - Enamine - Amine - Organic oxygen compound - Hydrocarbon derivative - Carbonyl group - Organic nitrogen compound - Organooxygen compound - Organic oxide - Organonitrogen compound - Aliphatic homomonocyclic 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