Compound Identification
SMILES
COC1=C(OCC#N)C=CC(\C=C\C(=O)O[C@H](C)C(=O)C2=C(C)NC3=CC=CC=C23)=C1
InChIKey
InChIKey=NIPUJIDZEORYOB-PXUDHTSWSA-N
Formula
C24H22N2O5
Mass
418.449
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Cinnamic acids and derivatives
-
Subclass
Hydroxycinnamic acids and derivatives
- Level 5 Coumaric acids and derivatives
-
Subclass
Hydroxycinnamic acids and derivatives
-
Class
Cinnamic acids and derivatives
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Cinnamic acids and derivatives
Subclass
Hydroxycinnamic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Coumaric acids and derivatives
Alternative Parents
Cinnamic acid esters Indoles Styrenes Phenoxy compounds Anisoles Methoxybenzenes Aryl alkyl ketones Alkyl aryl ethers Alpha-acyloxy ketones Fatty acid esters Substituted pyrroles Vinylogous amides Heteroaromatic compounds Enoate esters Nitriles Monocarboxylic acids and derivatives Azacyclic compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Coumaric acid or derivatives - Cinnamic acid ester - Indole - Indole or derivatives - Anisole - Phenoxy compound - Phenol ether - Styrene - Aryl ketone - Aryl alkyl ketone - Methoxybenzene - Fatty acid ester - Alpha-acyloxy ketone - Alkyl aryl ether - Fatty acyl - Benzenoid - Monocyclic benzene moiety - Substituted pyrrole - Vinylogous amide - Heteroaromatic compound - Pyrrole - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Carboxylic acid ester - Ketone - Carboxylic acid derivative - Organoheterocyclic compound - Nitrile - Carbonitrile - Ether - Monocarboxylic acid or derivatives - Azacycle - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Cyanide - Carbonyl group - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as coumaric acids and derivatives. These are aromatic compounds containing Aromatic compounds containing a cinnamic acid moiety (or a derivative thereof) hydroxylated at the C2 (ortho-), C3 (meta-), or C4 (para-) carbon atom of the benzene ring.
External Descriptors
Not available