Compound Identification
SMILES
OC1=CC=C(C=C1)[C@@H]1CC(=O)C2=C(O1)C(Br)=C(O)C=C2O
InChIKey
InChIKey=VJIHZXIEHKBDFP-LBPRGKRZSA-N
Formula
C15H11BrO5
Mass
351.152
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Phenylpropanoids and polyketides
-
Class
Flavonoids
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Subclass
Flavans
- Level 5 Flavanones
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Subclass
Flavans
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Class
Flavonoids
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Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Flavonoids
Subclass
Flavans
Intermediate Tree Nodes
Not available
Direct Parent
Flavanones
Alternative Parents
4'-hydroxyflavonoids 5-hydroxyflavonoids 7-hydroxyflavonoids Chromones P-bromophenols Aryl alkyl ketones O-bromophenols 1-hydroxy-2-unsubstituted benzenoids Alkyl aryl ethers Aryl bromides Benzene and substituted derivatives Vinylogous acids Oxacyclic compounds Organic oxides Organobromides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
4'-hydroxyflavonoid - 5-hydroxyflavonoid - 7-hydroxyflavonoid - Flavanone - Hydroxyflavonoid - Chromone - Chromane - Benzopyran - 1-benzopyran - Aryl alkyl ketone - 2-bromophenol - 4-bromophenol - Aryl ketone - Alkyl aryl ether - Phenol - 1-hydroxy-2-unsubstituted benzenoid - Benzenoid - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Vinylogous acid - Ketone - Ether - Organoheterocyclic compound - Oxacycle - Organooxygen compound - Organic oxygen compound - Organic oxide - Organobromide - Hydrocarbon derivative - Organohalogen compound - 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