Compound Identification
SMILES
COC1=CC(OCC(=O)N2CC(C)N(CC3=CC=C(F)C=C3)CC2C)=C2C(=O)CC(OC2=C1)C1=CC=CC=C1
InChIKey
InChIKey=XYCKNPMLOFDKJL-UHFFFAOYSA-N
Formula
C31H33FN2O5
Mass
532.612
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Flavonoids
-
Subclass
O-methylated flavonoids
- Level 5 7-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
7-O-methylated flavonoids
Alternative Parents
Flavanones Chromones Anisoles Aryl alkyl ketones Benzylamines Phenylmethylamines N-alkylpiperazines Fluorobenzenes Alkyl aryl ethers Aralkylamines Aryl fluorides Tertiary carboxylic acid amides Trialkylamines Amino acids and derivatives Azacyclic compounds Oxacyclic compounds Hydrocarbon derivatives Organic oxides Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
7-methoxyflavonoid-skeleton - Flavanone - Flavan - Chromone - Chromane - Benzopyran - 1-benzopyran - Anisole - Benzylamine - Phenol ether - Phenylmethylamine - Aryl ketone - Aryl alkyl ketone - Aralkylamine - N-alkylpiperazine - Alkyl aryl ether - Fluorobenzene - Halobenzene - Benzenoid - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - 1,4-diazinane - Piperazine - Tertiary carboxylic acid amide - Ketone - Tertiary amine - Carboxamide group - Tertiary aliphatic amine - Amino acid or derivatives - Carboxylic acid derivative - Organoheterocyclic compound - Ether - Oxacycle - Azacycle - Hydrocarbon derivative - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Amine - Organofluoride - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 7-o-methylated flavonoids. These are flavonoids with methoxy groups attached to the C7 atom of the flavonoid backbone.
External Descriptors
Not available