Structure Information
Structure

Compound Identification

SMILES

CC1=CC=C(C=C1)S(O)(=O)=O.CC1=CC=C(C=C1)S(O)(=O)=O.[O-][N+](=O)C1=CC=C(C=C1)[C@@H]1OC2=CC=CC=C2C(=O)[C@H]1[Tl]

InChIKey

InChIKey=DRVUWPVXEFPEOR-HKPSJHCMSA-N

Formula

C29H26NO10S2Tl

Mass

817.02

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Flavonoids

Subclass

Flavans

Intermediate Tree Nodes

Not available

Direct Parent

Flavanones

Alternative Parents

Molecular Framework

Not available

Substituents

Flavanone - Chromone - P-methylbenzenesulfonate - Chromane - Benzopyran - Benzenesulfonate - Tosyl compound - 1-benzopyran - Arylsulfonic acid or derivatives - Nitrobenzene - 1-sulfo,2-unsubstituted aromatic compound - Benzenesulfonyl group - Aryl ketone - Nitroaromatic compound - Aryl alkyl ketone - Toluene - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Ketone - C-nitro compound - Organic nitro compound - Propargyl-type 1,3-dipolar organic compound - Ether - Organic oxoazanium - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Oxacycle - Organoheterocyclic compound - Organic zwitterion - Organic post-transition metal moeity - Organometallic compound - Organonitrogen compound - Organothalium compound - Organooxygen compound - Organic oxygen compound - Organosulfur compound - Organic nitrogen compound - Organic oxide - Organic salt - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as flavanones. These are compounds containing a flavan-3-one moiety, with a structure characterized by a 2-phenyl-3,4-dihydro-2H-1-benzopyran bearing a ketone at the carbon C3.

External Descriptors

Not available

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