Compound Identification
SMILES
COC1=C(O)C=CC(\C=C\C(=O)NC2=C(C=CC(O)=C2)C(O)=O)=C1
InChIKey
InChIKey=CPDWXVCLMQZMBA-XVNBXDOJSA-N
Formula
C17H15NO6
Mass
329.308
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Phenylpropanoids and polyketides
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Class
Cinnamic acids and derivatives
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Subclass
Hydroxycinnamic acids and derivatives
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Level 5
Hydroxycinnamic acids
- Level 6 Avenanthramides
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Level 5
Hydroxycinnamic acids
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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
Hydroxycinnamic acids
Direct Parent
Avenanthramides
Alternative Parents
N-cinnamoylanthranilic acids Acylaminobenzoic acid and derivatives Hydroxybenzoic acid derivatives Methoxyphenols Anilides Benzoic acids N-arylamides Methoxybenzenes Styrenes Benzoyl derivatives Anisoles Phenoxy compounds 1-hydroxy-2-unsubstituted benzenoids Alkyl aryl ethers Vinylogous amides Secondary carboxylic acid amides Carboxylic acids Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Avenanthramide - N-cinnamoylanthranilic acid - Acylaminobenzoic acid or derivatives - Cinnamic acid amide - Hydroxybenzoic acid - Methoxyphenol - Benzoic acid or derivatives - Benzoic acid - Anilide - Anisole - Phenoxy compound - Benzoyl - Phenol ether - Styrene - N-arylamide - Methoxybenzene - Phenol - Alkyl aryl ether - 1-hydroxy-2-unsubstituted benzenoid - Monocyclic benzene moiety - Benzenoid - Vinylogous amide - Secondary carboxylic acid amide - Carboxamide group - Ether - Carboxylic acid derivative - Carboxylic acid - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Organonitrogen compound - Hydrocarbon derivative - Organooxygen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as avenanthramides. These are a group of phenolic alkaloids consisting of conjugate of three phenylpropanoids (ferulic, caffeic, or p-coumaric acid) and anthranilic acid.
External Descriptors
Not available