Compound Identification
SMILES
COC1=CC=CC=C1O[C@@H](CO[C@@H]1OC[C@@H](OC(=O)C2=CC=CC=C2)[C@H](OC(=O)C2=CC=CC=C2)[C@H]1OC(=O)C1=CC=CC=C1)[C@@H](O)C1=CC(OC)=C(OCC2=CC=CC=C2)C=C1
InChIKey
InChIKey=YEMWRHLONJRGRV-BTJINAAKSA-N
Formula
C50H46O13
Mass
854.905
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lignans, neolignans and related compounds
- Class Lignan glycosides
-
Superclass
Lignans, neolignans and related compounds
Kingdom
Organic compounds
Superclass
Lignans, neolignans and related compounds
Class
Lignan glycosides
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Lignan glycosides
Alternative Parents
O-glycosyl compounds Benzoic acid esters Tricarboxylic acids and derivatives Anisoles Benzoyl derivatives Methoxybenzenes Phenoxy compounds Alkyl aryl ethers Monosaccharides Oxanes Carboxylic acid esters Secondary alcohols Acetals Oxacyclic compounds Hydrocarbon derivatives Aromatic alcohols Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Lignan glycoside - Glycosyl compound - O-glycosyl compound - Benzoate ester - Tricarboxylic acid or derivatives - Benzoic acid or derivatives - Methoxybenzene - Anisole - Phenol ether - Benzoyl - Phenoxy compound - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Oxane - Monosaccharide - Secondary alcohol - Carboxylic acid ester - Ether - Carboxylic acid derivative - Acetal - Organoheterocyclic compound - Oxacycle - Alcohol - Organooxygen compound - Hydrocarbon derivative - Aromatic alcohol - Organic oxide - Organic oxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as lignan glycosides. These are aromatic polycyclic compounds containing a carbohydrate component glycosidically linked to a lignan moiety. They include 1-aryltetralin lactones.
External Descriptors
Not available