Compound Identification
SMILES
COC1=C(OC)C=C2C(=C1)C(=O)C1C(COC1=O)C2(O)C1=CC2=C(OCO2)C=C1
InChIKey
InChIKey=KYYBJRMYOHQEJG-UHFFFAOYSA-N
Formula
C21H18O8
Mass
398.367
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
Aryltetralin lignans Naphthofurans Tetralins Benzodioxoles Anisoles Aryl alkyl ketones Alkyl aryl ethers 1,3-dicarbonyl compounds Gamma butyrolactones Oxolanes Tertiary alcohols Carboxylic acid esters Monocarboxylic acids and derivatives Oxacyclic compounds Acetals Organic oxides Aldehydes Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Lignan lactone - 1-aryltetralin lignan - Naphthofuran - Tetralin - Benzodioxole - Anisole - Aryl alkyl ketone - Aryl ketone - Alkyl aryl ether - Gamma butyrolactone - Benzenoid - 1,3-dicarbonyl compound - Oxolane - Tertiary alcohol - Ketone - Lactone - Carboxylic acid ester - Acetal - Carboxylic acid derivative - Oxacycle - Ether - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Carbonyl group - Hydrocarbon derivative - Alcohol - Aldehyde - Organic oxygen compound - Organic oxide - Organooxygen 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