Compound Identification
SMILES
[Cl-].COC1=CC=CC=C1\C=C\C(=O)OCC[NH+](C)C
InChIKey
InChIKey=POXFHSZGNHHZQU-HRNDJLQDSA-N
Formula
C14H20ClNO3
Mass
285.77
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
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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 Styrenes Anisoles Phenoxy compounds Methoxybenzenes Alkyl aryl ethers Fatty acid esters Quaternary ammonium salts Enoate esters Trialkylamines Monocarboxylic acids and derivatives Hydrocarbon derivatives Organic chloride salts Organic oxides Carbonyl compounds Organic cations
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Coumaric acid or derivatives - Cinnamic acid ester - Anisole - Phenol ether - Styrene - Phenoxy compound - Methoxybenzene - Alkyl aryl ether - Fatty acid ester - Fatty acyl - Monocyclic benzene moiety - Benzenoid - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Quaternary ammonium salt - Carboxylic acid ester - Tertiary aliphatic amine - Carboxylic acid derivative - Ether - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic oxide - Organonitrogen compound - Organooxygen compound - Amine - Organic nitrogen compound - Carbonyl group - Organic chloride salt - Organic salt - Hydrocarbon derivative - Organic cation - Aromatic homomonocyclic 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