Compound Identification
SMILES
BrC1=CC2=C(O[C@H]([C@H](OC(=O)NCCOC3=CC=CC=C3)C2=O)C2=CC3=C(OCO3)C=C2)C=C1
InChIKey
InChIKey=VDVFZWMAAMGFJZ-BJKOFHAPSA-N
Formula
C25H20BrNO7
Mass
526.339
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Phenylpropanoids and polyketides
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Class
Flavonoids
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Subclass
Flavans
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Level 5
Flavanones
- Level 6 Flavanonols
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Level 5
Flavanones
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Subclass
Flavans
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Class
Flavonoids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Flavonoids
Subclass
Flavans
Intermediate Tree Nodes
Flavanones
Direct Parent
Flavanonols
Alternative Parents
Chromones Benzodioxoles Phenoxy compounds Phenol ethers Aryl alkyl ketones Alkyl aryl ethers Aryl bromides Carbamate esters Oxacyclic compounds Acetals Hydrocarbon derivatives Organic oxides Organobromides Organonitrogen compounds Aldehydes Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Flavanonol - Chromone - Chromane - Benzopyran - 1-benzopyran - Benzodioxole - Phenoxy compound - Phenol ether - Aryl ketone - Aryl alkyl ketone - Alkyl aryl ether - Benzenoid - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Carbamic acid ester - Ketone - Oxacycle - Organoheterocyclic compound - Acetal - Ether - Hydrocarbon derivative - Organopnictogen compound - Carbonyl group - Organic oxygen compound - Organic oxide - Organic nitrogen compound - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Aldehyde - 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