Compound Identification
SMILES
COC1=CC(=CC2=C1OC(CO)C(O2)C1=CC(OC)=C(O)C=C1)C1=CC(=O)C2=C(O1)C=C(O)C=C2
InChIKey
InChIKey=PMNLUZQOBUTAOJ-UHFFFAOYSA-N
Formula
C26H22O9
Mass
478.453
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lignans, neolignans and related compounds
- Class Flavonolignans
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Superclass
Lignans, neolignans and related compounds
Kingdom
Organic compounds
Superclass
Lignans, neolignans and related compounds
Class
Flavonolignans
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Flavonolignans
Alternative Parents
3'-O-methylated flavonoids 7-hydroxyflavonoids Flavones Phenylbenzo-1,4-dioxanes Chromones Methoxyphenols Benzo-1,4-dioxanes Phenoxy compounds Methoxybenzenes Anisoles Pyranones and derivatives 1-hydroxy-2-unsubstituted benzenoids Alkyl aryl ethers Para dioxins Heteroaromatic compounds Oxacyclic compounds Organic oxides Primary alcohols Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Flavonolignan - 3p-methoxyflavonoid-skeleton - 7-hydroxyflavonoid - Flavone - Hydroxyflavonoid - 2-phenylbenzo-1,4-dioxane - Phenylbenzodioxane - Chromone - Benzo-1,4-dioxane - Benzodioxane - Benzopyran - Methoxyphenol - 1-benzopyran - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - Pyranone - Phenol - 1-hydroxy-2-unsubstituted benzenoid - Para-dioxin - Benzenoid - Pyran - Monocyclic benzene moiety - Heteroaromatic compound - Organoheterocyclic compound - Oxacycle - Ether - Primary alcohol - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Alcohol - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as flavonolignans. These are non-conventional lignans that derived from flavonoids. They are characterized by a p-dioxin ring substituted at one carbon atom by a C3C6 (phenylpropan) group and fused to the B-ring of the 2-phenylchromene moiety.
External Descriptors
Not available