Compound Identification
SMILES
Cl.CCOC(=O)N1CCC(CC1)N[C@H]1[C@H]2COC(=O)C2C(C2=CC(OC)=C(O)C(OC)=C2)C2=CC3=C(OCO3)C=C12
InChIKey
InChIKey=NIFAUZLHLDJVMD-JMJLHCGTSA-N
Formula
C29H35ClN2O9
Mass
591.05
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 Methoxyphenols Dimethoxybenzenes Piperidinecarboxylic acids Benzodioxoles Phenoxy compounds Anisoles Alkyl aryl ethers Aminopiperidines Aralkylamines Gamma butyrolactones Tetrahydrofurans Carbamate esters Organic carbonic acids and derivatives Carboxylic acid esters Azacyclic compounds Monocarboxylic acids and derivatives Acetals Oxacyclic compounds Dialkylamines Carbonyl compounds Hydrocarbon derivatives Hydrochlorides Organic oxides Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Lignan lactone - Tametraline - 1-aryltetralin lignan - Linear furanonaphthodioxole - Naphthofuran - Methoxyphenol - Tetralin - Dimethoxybenzene - M-dimethoxybenzene - Piperidinecarboxylic acid - Benzodioxole - Methoxybenzene - Phenoxy compound - Phenol ether - Anisole - Alkyl aryl ether - Aralkylamine - Phenol - 4-aminopiperidine - Gamma butyrolactone - Benzenoid - Piperidine - Monocyclic benzene moiety - Carbamic acid ester - Tetrahydrofuran - Carbonic acid derivative - Lactone - Amino acid or derivatives - Carboxylic acid ester - Acetal - Oxacycle - Carboxylic acid derivative - Azacycle - Secondary aliphatic amine - Ether - Organoheterocyclic compound - Secondary amine - Monocarboxylic acid or derivatives - Amine - Carbonyl group - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrochloride - Hydrocarbon derivative - Organooxygen compound - Organic nitrogen compound - Organonitrogen 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