Compound Identification
SMILES
CC([O-])=O.CCC(NC1=CC=C(C=C(C#N)C(=O)OCC[N+](C)(C)C)C=C1)C1=CC=CC=C1
InChIKey
InChIKey=KRJZUGQVEDERBB-UHFFFAOYSA-N
Formula
C26H33N3O4
Mass
451.567
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Cinnamic acids and derivatives
- Subclass Cinnamic acid esters
-
Class
Cinnamic acids and derivatives
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Cinnamic acids and derivatives
Subclass
Cinnamic acid esters
Intermediate Tree Nodes
Not available
Direct Parent
Cinnamic acid esters
Alternative Parents
Phenylpropylamines Phenylpropanes Acyl cholines Phenylalkylamines Aniline and substituted anilines Secondary alkylarylamines Fatty acid esters Tetraalkylammonium salts Enoate esters Amino acids and derivatives Nitriles Carboxylic acids Monocarboxylic acids and derivatives Carbonyl compounds Organic oxides Organic zwitterions Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
Cinnamic acid ester - Phenylpropylamine - Acyl choline - Phenylpropane - Phenylalkylamine - Aniline or substituted anilines - Fatty acid ester - Secondary aliphatic/aromatic amine - Aralkylamine - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Tetraalkylammonium salt - Quaternary ammonium salt - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Amino acid or derivatives - Carboxylic acid ester - Secondary amine - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Nitrile - Carbonitrile - Organic zwitterion - Organonitrogen compound - Cyanide - Organooxygen compound - Organic oxide - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Amine - Hydrocarbon derivative - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as cinnamic acid esters. These are compound containing an ester derivative of cinnamic acid.
External Descriptors
Not available