Compound Identification
SMILES
OCCNCCO.CC=CCC=CC(O)=O.COC1=CC=C(C=CC(O)=O)C=C1
InChIKey
InChIKey=HWSRCXVESCGSJN-UHFFFAOYSA-N
Formula
C21H31NO7
Mass
409.479
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Cinnamic acids and derivatives
- Subclass Cinnamic acids
-
Class
Cinnamic acids and derivatives
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Cinnamic acids and derivatives
Subclass
Cinnamic acids
Intermediate Tree Nodes
Not available
Direct Parent
Cinnamic acids
Alternative Parents
Styrenes Phenoxy compounds Anisoles Methoxybenzenes Medium-chain fatty acids Alkyl aryl ethers Unsaturated fatty acids Straight chain fatty acids 1,2-aminoalcohols Monocarboxylic acids and derivatives Carboxylic acids Dialkylamines Carbonyl compounds Organic oxides Primary alcohols Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
Cinnamic acid - Phenoxy compound - Phenol ether - Anisole - Methoxybenzene - Styrene - Medium-chain fatty acid - Alkyl aryl ether - Monocyclic benzene moiety - Straight chain fatty acid - Fatty acyl - Unsaturated fatty acid - Fatty acid - Benzenoid - 1,2-aminoalcohol - Alkanolamine - Secondary amine - Secondary aliphatic amine - Ether - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Carbonyl group - Primary alcohol - Hydrocarbon derivative - Amine - Organic oxide - Organic oxygen compound - Alcohol - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as cinnamic acids. These are organic aromatic compounds containing a benzene and a carboxylic acid group forming 3-phenylprop-2-enoic acid.
External Descriptors
Not available