Compound Identification
SMILES
COCOC1=CC2=C(OCO2)C=C1\C=C\C(=O)C1=C(O)C(OC)=C(OCOC)C=C1
InChIKey
InChIKey=OWQPJYHIBKUQNS-GQCTYLIASA-N
Formula
C21H22O9
Mass
418.398
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Phenylpropanoids and polyketides
-
Class
Linear 1,3-diarylpropanoids
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Subclass
Chalcones and dihydrochalcones
- Level 5 2'-Hydroxychalcones
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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
2'-Hydroxychalcones
Alternative Parents
Cinnamic acids and derivatives Methoxyphenols Benzodioxoles Styrenes Anisoles Aryl ketones Phenoxy compounds Benzoyl derivatives Methoxybenzenes Alkyl aryl ethers 1-hydroxy-4-unsubstituted benzenoids Vinylogous acids Acryloyl compounds Enones Acetals Oxacyclic compounds Aldehydes Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2'-hydroxychalcone - Cinnamic acid or derivatives - Methoxyphenol - Benzodioxole - Anisole - Phenoxy compound - Benzoyl - Phenol ether - Styrene - Aryl ketone - Methoxybenzene - 1-hydroxy-4-unsubstituted benzenoid - Phenol - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Vinylogous acid - Alpha,beta-unsaturated ketone - Acryloyl-group - Enone - Ketone - Organoheterocyclic compound - Acetal - Oxacycle - Ether - Aldehyde - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 2'-hydroxychalcones. These are organic compounds containing chalcone skeleton that carries a hydroxyl group at the 2'-position.
External Descriptors
Not available