Structure Information
Structure

Compound Identification

SMILES

CNC[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO.COC1=C(O)C=CC(=C1)[C@H]1OC2=C(O[C@@H]1CO)C=CC(=C2)[C@H]1OC2=CC(O)=CC(O)=C2C(=O)[C@@H]1O

InChIKey

InChIKey=XJCLWAHIAAEFAT-FUVGLPQDSA-N

Formula

C32H39NO15

Mass

677.656

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lignans, neolignans and related compounds

Class

Flavonolignans

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Flavonolignans

Alternative Parents

Molecular Framework

Not available

Substituents

Flavonolignan - 3-hydroxyflavonoid - Hydroxyflavonoid - 5-hydroxyflavonoid - 7-hydroxyflavonoid - Flavanonol - Flavanone - Flavan - 2-phenylbenzo-1,4-dioxane - Phenylbenzodioxane - Hexose monosaccharide - Chromone - Methoxyphenol - Benzo-1,4-dioxane - Benzodioxane - Benzopyran - 1-benzopyran - Chromane - Phenoxy compound - Methoxybenzene - Anisole - Aryl alkyl ketone - Phenol ether - Aryl ketone - Phenol - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Para-dioxin - Monosaccharide - 1,3-aminoalcohol - Vinylogous acid - Ketone - 1,2-aminoalcohol - 1,2-diol - Secondary alcohol - Secondary amine - Polyol - Organoheterocyclic compound - Oxacycle - Secondary aliphatic amine - Ether - Organonitrogen compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - Alcohol - Organic oxide - Organic oxygen compound - Organooxygen compound - Primary alcohol - 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

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