Compound Identification
SMILES
COC1=C(O)C=CC(=C1)C1OC2=C(OC1COC(=O)C1=CC(OC)=C(OC)C=C1)C=CC(=C2)[C@H]1OC2=CC(O)=CC(O)=C2C(=O)[C@@H]1O
InChIKey
InChIKey=KLDNHNLUMFGOCH-HZGPAMHYSA-N
Formula
C34H30O13
Mass
646.601
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lignans, neolignans and related compounds
- Class Flavonolignans
-
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-hydroxyflavonoids 5-hydroxyflavonoids 7-hydroxyflavonoids Flavanonols Phenylbenzo-1,4-dioxanes P-methoxybenzoic acids and derivatives Chromones M-methoxybenzoic acids and derivatives Benzo-1,4-dioxanes Benzoic acid esters Dimethoxybenzenes Methoxyphenols Anisoles Aryl alkyl ketones Phenoxy compounds Benzoyl derivatives 1-hydroxy-4-unsubstituted benzenoids 1-hydroxy-2-unsubstituted benzenoids Alkyl aryl ethers Para dioxins Vinylogous acids Secondary alcohols Carboxylic acid esters Polyols Oxacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Flavonolignan - 3-hydroxyflavonoid - 5-hydroxyflavonoid - 7-hydroxyflavonoid - Flavanone - Flavanonol - Hydroxyflavonoid - Flavan - 2-phenylbenzo-1,4-dioxane - Phenylbenzodioxane - Chromone - M-methoxybenzoic acid or derivatives - P-methoxybenzoic acid or derivatives - Benzo-1,4-dioxane - Benzodioxane - Benzoate ester - Chromane - Benzopyran - O-dimethoxybenzene - Dimethoxybenzene - Methoxyphenol - 1-benzopyran - Benzoic acid or derivatives - Aryl ketone - Phenoxy compound - Aryl alkyl ketone - Phenol ether - Benzoyl - Anisole - Methoxybenzene - Phenol - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Para-dioxin - Monocyclic benzene moiety - Benzenoid - Vinylogous acid - Carboxylic acid ester - Ketone - Secondary alcohol - Carboxylic acid derivative - Oxacycle - Polyol - Ether - Organoheterocyclic compound - Hydrocarbon derivative - Organic oxygen compound - Organooxygen compound - Alcohol - Organic oxide - 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