Compound Identification
SMILES
COC1=CC(\C=C\C(=O)C2=CC=C(C=C2)S(N)(=O)=O)=CC(OC)=C1OC
InChIKey
InChIKey=VWGHRVXQXAIXFK-RUDMXATFSA-N
Formula
C18H19NO6S
Mass
377.41
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 Benzenesulfonamides Benzenesulfonyl compounds Anisoles Aryl ketones Styrenes Phenoxy compounds Benzoyl derivatives Methoxybenzenes Alkyl aryl ethers Organosulfonamides Acryloyl compounds Enones Aminosulfonyl compounds Hydrocarbon derivatives Organic nitrogen compounds Organic oxides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Retrochalcone - Cinnamic acid or derivatives - Benzenesulfonamide - Benzenesulfonyl group - Anisole - Benzoyl - Phenoxy compound - Phenol ether - Styrene - Aryl ketone - Methoxybenzene - Alkyl aryl ether - Benzenoid - Organosulfonic acid amide - Monocyclic benzene moiety - Aminosulfonyl compound - Alpha,beta-unsaturated ketone - Sulfonyl - Acryloyl-group - Enone - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Ketone - Ether - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organosulfur compound - Organic oxide - Organic oxygen compound - 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