Compound Identification
SMILES
COC1=CC(OC)=C(\C=C\C(=O)C2=CC=C(C=C2)S(N)(=O)=O)C=C1C1=CC2=CC=CC=C2S1
InChIKey
InChIKey=JPABBOMUUSNZAG-FMIVXFBMSA-N
Formula
C25H21NO5S2
Mass
479.57
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Phenylpropanoids and polyketides
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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
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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 Dimethoxybenzenes 1-benzothiophenes Benzenesulfonyl compounds Styrenes 2,3,5-trisubstituted thiophenes Anisoles Aryl ketones Phenoxy compounds Benzoyl derivatives Alkyl aryl ethers Organosulfonamides Aminosulfonyl compounds Acryloyl compounds Enones Heteroaromatic compounds Organic oxides Organic nitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Retrochalcone - Cinnamic acid or derivatives - Dimethoxybenzene - M-dimethoxybenzene - Benzenesulfonamide - Benzothiophene - 1-benzothiophene - Benzenesulfonyl group - Methoxybenzene - Anisole - Benzoyl - Phenoxy compound - Aryl ketone - 2,3,5-trisubstituted thiophene - Styrene - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Organosulfonic acid amide - Acryloyl-group - Heteroaromatic compound - Alpha,beta-unsaturated ketone - Enone - Aminosulfonyl compound - Thiophene - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Ketone - Ether - Organoheterocyclic compound - Organooxygen compound - Organosulfur compound - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Aromatic heteropolycyclic 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