Compound Identification
SMILES
COCC1=C(OC)C=CC(=C1)C(=O)\C=C\C1=CC(=C([O-])C=C1)[N+]([O-])=O
InChIKey
InChIKey=REZDJYRXRIJCLM-ZZXKWVIFSA-M
Formula
C18H16NO6
Mass
342.328
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Linear 1,3-diarylpropanoids
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Subclass
Chalcones and dihydrochalcones
- Level 5 Retrochalcones
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Subclass
Chalcones and dihydrochalcones
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Class
Linear 1,3-diarylpropanoids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Linear 1,3-diarylpropanoids
Subclass
Chalcones and dihydrochalcones
Intermediate Tree Nodes
Not available
Direct Parent
Retrochalcones
Alternative Parents
Cinnamic acids and derivatives Benzylethers Nitrobenzenes Anisoles Aryl ketones Benzoyl derivatives Styrenes Phenoxy compounds Methoxybenzenes Nitroaromatic compounds Alkyl aryl ethers Phenoxides Enones Acryloyl compounds Dialkyl ethers Organic oxoazanium compounds Hydrocarbon derivatives Organic oxides Organic salts Organonitrogen compounds Organic cations
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Retrochalcone - Cinnamic acid or derivatives - Nitrobenzene - Benzylether - Phenoxy compound - Phenol ether - Styrene - Nitroaromatic compound - Aryl ketone - Benzoyl - Methoxybenzene - Anisole - Alkyl aryl ether - Phenoxide - Benzenoid - Monocyclic benzene moiety - Enone - Alpha,beta-unsaturated ketone - Acryloyl-group - C-nitro compound - Organic nitro compound - Ketone - Dialkyl ether - Ether - Organic oxoazanium - Organic nitrogen compound - Organooxygen compound - Organic salt - Hydrocarbon derivative - Organonitrogen compound - Organic oxygen compound - Organic oxide - Organic cation - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as retrochalcones. These are a form of normal chalcones that are structurally distinguished by the lack of oxygen functionalities at the C2'- and C6'-positions.
External Descriptors
Not available