Compound Identification
SMILES
COC1=CC(=CC(OC)=C1OC)C1C2C(COC2=O)CC2=C(OS(O)(=O)=O)C3=C(OCO3)C=C12
InChIKey
InChIKey=PQPHZXCQGIFYQT-UHFFFAOYSA-N
Formula
C22H22O11S
Mass
494.47
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 Furanonaphthodioxoles Tetralins Arylsulfates Benzodioxoles Anisoles Phenoxy compounds Methoxybenzenes Alkyl aryl ethers Sulfuric acid monoesters Gamma butyrolactones Tetrahydrofurans Carboxylic acid esters Monocarboxylic acids and derivatives Oxacyclic compounds Acetals Carbonyl compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Lignan lactone - 1-aryltetralin lignan - Linear furanonaphthodioxole - Naphthofuran - Arylsulfate - Tetralin - Benzodioxole - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Gamma butyrolactone - Sulfuric acid ester - Sulfate-ester - Sulfuric acid monoester - Benzenoid - Tetrahydrofuran - Organic sulfuric acid or derivatives - Carboxylic acid ester - Lactone - Organoheterocyclic compound - Ether - Acetal - Carboxylic acid derivative - Oxacycle - Monocarboxylic acid or derivatives - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - 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