Compound Identification
SMILES
COC1=CC(=CC(OC)=C1O)C1[C@@H]2C(COC2=O)[C@H](NC2=CC3=C(OCCO3)C=C2)C2=CC3=C(OCO3)C=C12
InChIKey
InChIKey=UJDWLKBEKWSXBS-SCWZWCFPSA-N
Formula
C29H27NO9
Mass
533.533
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lignans, neolignans and related compounds
- Class Lignan lactones
-
Superclass
Lignans, neolignans and related compounds
Kingdom
Organic compounds
Superclass
Lignans, neolignans and related compounds
Class
Lignan lactones
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Lignan lactones
Alternative Parents
Tametralines Aryltetralin lignans Furanonaphthodioxoles Benzo-1,4-dioxanes Methoxyphenols Dimethoxybenzenes Benzodioxoles Phenoxy compounds Anisoles Alkyl aryl ethers Secondary alkylarylamines Aralkylamines Para dioxins Gamma butyrolactones Tetrahydrofurans Carboxylic acid esters Amino acids and derivatives Monocarboxylic acids and derivatives Oxacyclic compounds Acetals Carbonyl compounds Organic oxides Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Lignan lactone - Tametraline - 1-aryltetralin lignan - Linear furanonaphthodioxole - Naphthofuran - Tetralin - Methoxyphenol - Dimethoxybenzene - M-dimethoxybenzene - Benzo-1,4-dioxane - Benzodioxane - Benzodioxole - Anisole - Phenol ether - Methoxybenzene - Phenoxy compound - Aralkylamine - Phenol - Alkyl aryl ether - Secondary aliphatic/aromatic amine - Monocyclic benzene moiety - Gamma butyrolactone - Benzenoid - Para-dioxin - Tetrahydrofuran - Lactone - Amino acid or derivatives - Carboxylic acid ester - Secondary amine - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Oxacycle - Ether - Carboxylic acid derivative - Acetal - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Carbonyl group - Organic oxygen compound - Organooxygen compound - Organic nitrogen compound - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as lignan lactones. These are lignans that contain a lactone moiety. They include 1-aryltetralin lactones, dibenzylbutyrolactone lignans, and podophyllotoxins, among others.
External Descriptors
Not available