Compound Identification
SMILES
COC1=CC(=CC(OC)=C1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H]1OC2=C(O[C@@H]1CO)C1=C(C=CC(=O)O1)C=C2
InChIKey
InChIKey=UFNILYRCPSTPHP-BPCUWKSQSA-N
Formula
C26H28O13
Mass
548.497
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lignans, neolignans and related compounds
- Class Coumarinolignans
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Superclass
Lignans, neolignans and related compounds
Kingdom
Organic compounds
Superclass
Lignans, neolignans and related compounds
Class
Coumarinolignans
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Coumarinolignans
Alternative Parents
Phenylbenzo-1,4-dioxanes p-Dioxolo[2,3-h]coumarins Phenolic glycosides Hexoses O-glycosyl compounds 1-benzopyrans Benzo-1,4-dioxanes Dimethoxybenzenes Anisoles Phenoxy compounds Pyranones and derivatives Alkyl aryl ethers Oxanes Para dioxins Heteroaromatic compounds Lactones Secondary alcohols Oxacyclic compounds Acetals Polyols Organic oxides Hydrocarbon derivatives Primary alcohols
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Angular-fused coumarolignan skeleton - 2-phenylbenzo-1,4-dioxane - Phenylbenzodioxane - Phenolic glycoside - P-dioxolo[2,3-h]coumarin - Hexose monosaccharide - Coumarin - Glycosyl compound - O-glycosyl compound - Dimethoxybenzene - M-dimethoxybenzene - 1-benzopyran - Benzo-1,4-dioxane - Benzodioxane - Benzopyran - Methoxybenzene - Anisole - Phenoxy compound - Phenol ether - Pyranone - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Pyran - Monosaccharide - Oxane - Para-dioxin - Heteroaromatic compound - Lactone - Secondary alcohol - Ether - Acetal - Oxacycle - Organoheterocyclic compound - Polyol - Organic oxygen compound - Alcohol - Primary alcohol - Hydrocarbon derivative - Organooxygen compound - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as coumarinolignans. These are lignans with a structure characterized by the presence of a 1,4-dioxane bridge substituted by a phenyl group, and fused to a coumarin.
External Descriptors
Not available