Compound Identification
SMILES
COC1=CC=C(C=C1)C1(OC2=C(C=C1)C1=CC=CC=C1C(=C2)N1CCOCC1)C1=CC=C(OC(F)(F)F)C=C1
InChIKey
InChIKey=OAFFKZJCCMNLLC-UHFFFAOYSA-N
Formula
C31H26F3NO4
Mass
533.547
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Flavonoids
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Subclass
O-methylated flavonoids
- Level 5 4'-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
4'-O-methylated flavonoids
Alternative Parents
Flav-3-enes Naphthopyrans Diphenylmethanes 1-benzopyrans Naphthalenes Phenoxy compounds Methoxybenzenes Anisoles Dialkylarylamines Alkyl aryl ethers Pyrans Morpholines Trihalomethanes Oxacyclic compounds Azacyclic compounds Dialkyl ethers Hydrocarbon derivatives Organofluorides Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
4p-methoxyflavonoid-skeleton - Flav-3-ene - Naphthopyran - Diphenylmethane - Benzopyran - Naphthalene - 1-benzopyran - Phenoxy compound - Anisole - Methoxybenzene - Dialkylarylamine - Phenol ether - Tertiary aliphatic/aromatic amine - Alkyl aryl ether - Monocyclic benzene moiety - Morpholine - Oxazinane - Pyran - Benzenoid - Tertiary amine - Trihalomethane - Organoheterocyclic compound - Dialkyl ether - Ether - Oxacycle - Azacycle - Alkyl halide - Hydrocarbon derivative - Amine - Halomethane - Organic nitrogen compound - Organonitrogen compound - Organic oxygen compound - Organooxygen compound - Alkyl fluoride - Organohalogen compound - Organofluoride - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 4'-o-methylated flavonoids. These are flavonoids with methoxy groups attached to the C4' atom of the flavonoid backbone.
External Descriptors
Not available