Compound Identification
SMILES
COC1=CC=CC2=C1C1=C(C=C(C=C1)C(C)S(N)(=O)=O)C(O2)C1=CC(F)=CC=C1
InChIKey
InChIKey=DKICTROBZGQBEH-UHFFFAOYSA-N
Formula
C22H20FNO4S
Mass
413.46
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Flavonoids
-
Subclass
O-methylated flavonoids
- Level 5 5-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
5-O-methylated flavonoids
Alternative Parents
Dibenzopyrans 2-benzopyrans Anisoles Fluorobenzenes Alkyl aryl ethers Organosulfonamides Organic sulfonamides Aryl fluorides Aminosulfonyl compounds Oxacyclic compounds Organofluorides Organic oxides Organic nitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
5-methoxyflavonoid-skeleton - Dibenzopyran - Benzopyran - 1-benzopyran - 2-benzopyran - Anisole - Fluorobenzene - Halobenzene - Alkyl aryl ether - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Organic sulfonic acid amide - Organosulfonic acid amide - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Aminosulfonyl compound - Organoheterocyclic compound - Ether - Oxacycle - Organosulfur compound - Organooxygen compound - Organofluoride - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 5-o-methylated flavonoids. These are flavonoids with methoxy groups attached to the C5 atom of the flavonoid backbone.
External Descriptors
Not available