Compound Identification
SMILES
COC1=CC(\C=C\C(=O)C2=CC=C(NS(=O)(=O)C3=C(C)C=CC(=C3)[N+]([O-])=O)C=C2)=CC(OC)=C1OC
InChIKey
InChIKey=SNCSVRVFLIMCLR-WUXMJOGZSA-N
Formula
C25H24N2O8S
Mass
512.53
Taxonomic Classification
Taxonomy Tree
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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
Sulfanilides Benzenesulfonamides Benzenesulfonyl compounds Nitrobenzenes Nitrotoluenes Phenoxy compounds Anisoles Aryl ketones Styrenes Benzoyl derivatives Nitroaromatic compounds Methoxybenzenes Alkyl aryl ethers Organosulfonamides Acryloyl compounds Aminosulfonyl compounds Enones Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Organic oxides Organic zwitterions Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Retrochalcone - Benzenesulfonamide - Sulfanilide - Nitrobenzene - Nitrotoluene - Benzenesulfonyl group - Anisole - Phenoxy compound - Benzoyl - Methoxybenzene - Nitroaromatic compound - Styrene - Aryl ketone - Phenol ether - Toluene - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Organosulfonic acid amide - Alpha,beta-unsaturated ketone - Organic sulfonic acid or derivatives - Aminosulfonyl compound - Sulfonyl - Organosulfonic acid or derivatives - Enone - Acryloyl-group - Organic nitro compound - Ketone - C-nitro compound - Organic oxoazanium - Propargyl-type 1,3-dipolar organic compound - Ether - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organosulfur compound - Organic zwitterion - 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