Compound Identification
SMILES
COC1=CC(=CC(OC)=C1OC)[C@H]1[C@@H]2[C@H](COC2=O)[C@H](NC(=O)C2=C(Cl)N=CC=C2)C2=CC3=C(OCO3)C=C12
InChIKey
InChIKey=VSOMMXYUJPIWKK-QQJYNPJZSA-N
Formula
C28H25ClN2O8
Mass
552.96
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 Benzodioxoles Nicotinamides Phenoxy compounds Methoxybenzenes Anisoles 2-halopyridines Alkyl aryl ethers Gamma butyrolactones Aryl chlorides Vinylogous halides Heteroaromatic compounds Oxolanes Carboxylic acid esters Secondary carboxylic acid amides Oxacyclic compounds Azacyclic compounds Monocarboxylic acids and derivatives Acetals Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Lignan lactone - Tametraline - 1-aryltetralin lignan - Linear furanonaphthodioxole - Naphthofuran - Tetralin - Pyridinecarboxamide - Pyridine carboxylic acid or derivatives - Benzodioxole - Nicotinamide - Phenol ether - Methoxybenzene - Anisole - Phenoxy compound - 2-halopyridine - Alkyl aryl ether - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Gamma butyrolactone - Pyridine - Heteroaromatic compound - Vinylogous halide - Oxolane - Carboxamide group - Carboxylic acid ester - Lactone - Secondary carboxylic acid amide - Oxacycle - Acetal - Carboxylic acid derivative - Ether - Azacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Organohalogen compound - Organochloride - Carbonyl group - Organonitrogen compound - Organic nitrogen compound - Organooxygen compound - Organopnictogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - 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