Compound Identification
SMILES
COC1=CC=CC(=C1)[C@@H]1OC2=C(C[C@H]1OC(=O)NC1=CC=C(OC(F)F)C=C1)C=C(Br)C=C2
InChIKey
InChIKey=AFFYVJCFBFAFQC-YADHBBJMSA-N
Formula
C24H20BrF2NO5
Mass
520.327
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Flavonoids
-
Subclass
O-methylated flavonoids
- Level 5 3'-O-methylated flavonoids
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Subclass
O-methylated flavonoids
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Class
Flavonoids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Flavonoids
Subclass
O-methylated flavonoids
Intermediate Tree Nodes
Not available
Direct Parent
3'-O-methylated flavonoids
Alternative Parents
Flavan-3-ols Phenylcarbamic acid esters 1-benzopyrans Phenoxy compounds Anisoles Methoxybenzenes Alkyl aryl ethers Aryl bromides Carbamate esters Oxacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organobromides Alkyl fluorides Organofluorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3p-methoxyflavonoid-skeleton - Flavan-3-ol - Flavan - Phenylcarbamic acid ester - Benzopyran - Chromane - 1-benzopyran - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Aryl halide - Benzenoid - Monocyclic benzene moiety - Aryl bromide - Carbamic acid ester - Oxacycle - Organoheterocyclic compound - Ether - Alkyl fluoride - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Alkyl halide - Organofluoride - Organobromide - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 3'-o-methylated flavonoids. These are flavonoids with methoxy groups attached to the C3' atom of the flavonoid backbone.
External Descriptors
Not available