Compound Identification
SMILES
COC1=CC2=C(O[C@H]([C@H](OC(=O)NC3=CC=C(OC(F)F)C=C3)C2=O)C2=CC(OC)=CC=C2)C=C1
InChIKey
InChIKey=NCNRGUDZLLHOIB-XZOQPEGZSA-N
Formula
C25H21F2NO7
Mass
485.44
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Flavonoids
-
Subclass
O-methylated flavonoids
- Level 5 6-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
6-O-methylated flavonoids
Alternative Parents
3'-O-methylated flavonoids Flavanonols Phenylcarbamic acid esters Chromones Phenoxy compounds Anisoles Methoxybenzenes Aryl alkyl ketones Alkyl aryl ethers Carbamate esters Oxacyclic compounds Hydrocarbon derivatives Organic oxides Alkyl fluorides Organofluorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3p-methoxyflavonoid-skeleton - 6-methoxyflavonoid-skeleton - Flavanonol - Flavanone - Flavan - Phenylcarbamic acid ester - Chromone - Benzopyran - Chromane - 1-benzopyran - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Aryl alkyl ketone - Aryl ketone - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Carbamic acid ester - Ketone - Oxacycle - Organoheterocyclic compound - Ether - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Alkyl halide - Alkyl fluoride - Organic oxide - Organofluoride - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 6-o-methylated flavonoids. These are flavonoids with methoxy groups attached to the C6 atom of the flavonoid backbone.
External Descriptors
Not available