Structure Information
Structure

Compound Identification

SMILES

COC1=CC(NC(=O)O[C@H]2[C@@H](OC3=C(C=C(Br)C=C3)C2=O)C2=CC3=C(OCO3)C=C2)=CC(OC)=C1OC

InChIKey

InChIKey=QSQFKZXXXKMANN-UKILVPOCSA-N

Formula

C26H22BrNO9

Mass

572.364

Export to:

JSON SDF CSV

Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Flavonoids

Subclass

Flavans

Intermediate Tree Nodes

Flavanones

Direct Parent

Flavanonols

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Flavanonol - Phenylcarbamic acid ester - Chromone - Chromane - Benzopyran - 1-benzopyran - Benzodioxole - Methoxyaniline - Methoxybenzene - Anisole - Aryl alkyl ketone - Aryl ketone - Phenol ether - Phenoxy compound - Alkyl aryl ether - Benzenoid - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Carbamic acid ester - Ketone - Oxacycle - Organoheterocyclic compound - Ether - Acetal - Organobromide - Carbonyl group - Organonitrogen compound - Organic nitrogen compound - Organic oxygen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Aldehyde - Organohalogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as flavanonols. 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 hydroxyl group and a ketone at the carbon C2 and C3, respectively.

External Descriptors

Not available

Previous Back Next