Compound Identification
SMILES
OC1=C(OC2=C(Br)C=C(Cl)C=C2C1=O)C1=CC=C(C=C1)C(F)(F)F
InChIKey
InChIKey=IOEUMMXOYVNGNE-UHFFFAOYSA-N
Formula
C16H7BrClF3O3
Mass
419.58
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
- Class Flavonoids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Flavonoids
Subclass
Flavones
Intermediate Tree Nodes
Not available
Direct Parent
Flavonols
Alternative Parents
3-hydroxyflavonoids Chromones Trifluoromethylbenzenes Pyranones and derivatives Aryl chlorides Aryl bromides Heteroaromatic compounds Oxacyclic compounds Organooxygen compounds Organofluorides Organochlorides Organobromides Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3-hydroxyflavone - 3-hydroxyflavonoid - Hydroxyflavonoid - Chromone - Trifluoromethylbenzene - 1-benzopyran - Benzopyran - Pyranone - Aryl bromide - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Pyran - Heteroaromatic compound - Oxacycle - Organoheterocyclic compound - Organochloride - Organofluoride - Organooxygen compound - Alkyl fluoride - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Alkyl halide - Organobromide - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as flavonols. These are compounds that contain a flavone (2-phenyl-1-benzopyran-4-one) backbone carrying a hydroxyl group at the 3-position.
External Descriptors
Not available