Compound Identification
SMILES
COC1=C(OC)C(OC)=C2C(CC3[C@@H](COC3=O)[C@H](OC(=O)C(\C)=C\C)C3=CC4=C(OCO4)C=C23)=C1
InChIKey
InChIKey=IIEOCQLKEFBZIS-IDTLENCQSA-N
Formula
C27H28O9
Mass
496.512
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
Dibenzocyclooctadiene lignans Benzodioxoles Anisoles Fatty acid esters Alkyl aryl ethers Gamma butyrolactones Dicarboxylic acids and derivatives Oxolanes Enoate esters Oxacyclic compounds Acetals Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Dibenzocyclooctane lignan - Lignan lactone - Benzodioxole - Anisole - Alkyl aryl ether - Fatty acid ester - Fatty acyl - Dicarboxylic acid or derivatives - Benzenoid - Gamma butyrolactone - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Oxolane - Carboxylic acid ester - Lactone - Ether - Organoheterocyclic compound - Oxacycle - Acetal - Carboxylic acid derivative - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organic oxygen compound - 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