Compound Identification
SMILES
CCC(O)(CC)C1=NN=C(NC(C)C2=CC3=C(C=C2)C(=CC(=O)O3)C2=CC=C(F)C=C2)O1
InChIKey
InChIKey=OBSGEYRFXMFTDO-UHFFFAOYSA-N
Formula
C24H24FN3O4
Mass
437.471
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Neoflavonoids
- Subclass Neoflavones
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Class
Neoflavonoids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Neoflavonoids
Subclass
Neoflavones
Intermediate Tree Nodes
Not available
Direct Parent
Neoflavones
Alternative Parents
Coumarins and derivatives 1-benzopyrans Secondary alkylarylamines Pyranones and derivatives Fluorobenzenes Aryl fluorides Tertiary alcohols 1,3,4-oxadiazoles Heteroaromatic compounds Lactones Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Aromatic alcohols Organofluorides Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
4-phenylcoumarin - Coumarin - Benzopyran - 1-benzopyran - Fluorobenzene - Halobenzene - Pyranone - Secondary aliphatic/aromatic amine - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Pyran - 1,3,4-oxadiazole - Azole - Heteroaromatic compound - Oxadiazole - Tertiary alcohol - Lactone - Azacycle - Oxacycle - Organoheterocyclic compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Alcohol - Organooxygen compound - Organic nitrogen compound - Aromatic alcohol - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as neoflavones. These are neoflavonoids with a structure based on the 4-phenylcoumarin skeleton.
External Descriptors
Not available