Compound Identification
SMILES
COC1=CC2=C(C=C1)C(C1=CC=C(\C=C\C(=O)OC(C)(C)C)C=C1)=C(C(=O)O2)C1=CC=CC=C1
InChIKey
InChIKey=OLCDHLJHUZFSFM-SFQUDFHCSA-N
Formula
C29H26O5
Mass
454.522
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
Isoflav-3-enones Cinnamic acid esters Coumarins and derivatives 1-benzopyrans Styrenes Anisoles Pyranones and derivatives Alkyl aryl ethers Fatty acid esters Enoate esters Heteroaromatic compounds Lactones Monocarboxylic acids and derivatives Oxacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoflav-3-enone skeleton - 4-phenylcoumarin - Isoflavonoid skeleton - Isoflavonoid - Cinnamic acid or derivatives - Cinnamic acid ester - Coumarin - 1-benzopyran - Benzopyran - Anisole - Styrene - Phenol ether - Pyranone - Alkyl aryl ether - Fatty acid ester - Fatty acyl - Benzenoid - Pyran - Monocyclic benzene moiety - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Heteroaromatic compound - Carboxylic acid ester - Lactone - Ether - Organoheterocyclic compound - Oxacycle - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Carbonyl group - Organooxygen compound - 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