Compound Identification
SMILES
NC(=O)CCCC1COC2=C(O1)C=C1C(OC(=O)C=C1C1=CC=CC(=C1)B(O)O)=C2
InChIKey
InChIKey=OVLMFIOAEOJAKG-UHFFFAOYSA-N
Formula
C21H20BNO7
Mass
409.2
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
p-Dioxolo[2,3-g]coumarins 1-benzopyrans Benzo-1,4-dioxanes Pyranones and derivatives Alkyl aryl ethers Para dioxins Benzene and substituted derivatives Fatty amides Heteroaromatic compounds Primary carboxylic acid amides Boronic acids Lactones Oxacyclic compounds Organic metalloid salts Organic oxides Carbonyl compounds Organometalloid compounds Hydrocarbon derivatives Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
4-phenylcoumarin - P-dioxolo[2,3-g]coumarin - Coumarin - Benzo-1,4-dioxane - Benzodioxane - Benzopyran - 1-benzopyran - Alkyl aryl ether - Pyranone - Monocyclic benzene moiety - Fatty amide - Para-dioxin - Pyran - Fatty acyl - Benzenoid - Heteroaromatic compound - Carboxamide group - Boronic acid derivative - Boronic acid - Primary carboxylic acid amide - Lactone - Oxacycle - Organic metalloid salt - Ether - Carboxylic acid derivative - Organoheterocyclic compound - Organic nitrogen compound - Carbonyl group - Organic metalloid moeity - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - 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