Compound Identification
SMILES
COC1=CC(=CC(OC)=C1OC(=O)[C@H](CC1=CC=C(O)C=C1)NC(=O)OC1CC(C)(C)N([O])C(C)(C)C1)[C@H]1[C@@H]2C(COC2=O)CC2=CC3=C(OCO3)C=C12
InChIKey
InChIKey=CISKOQJBEJSQEU-DZNRZLCCSA-N
Formula
C40H45N2O12
Mass
745.802
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
Tyrosine and derivatives Aryltetralin lignans Phenylalanine and derivatives Furanonaphthodioxoles Alpha amino acid esters Tetralins Dimethoxybenzenes Amphetamines and derivatives Phenol esters Benzodioxoles Phenoxy compounds Anisoles Fatty acid esters Alkyl aryl ethers 1-hydroxy-2-unsubstituted benzenoids Gamma butyrolactones Piperidines Dicarboxylic acids and derivatives Carbamate esters Oxolanes Carboxylic acid esters Oxacyclic compounds Acetals Azacyclic compounds Organic oxides Organonitrogen compounds Hydrocarbon derivatives Carbonyl compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Lignan lactone - Tyrosine or derivatives - 1-aryltetralin lignan - Phenylalanine or derivatives - Linear furanonaphthodioxole - Alpha-amino acid ester - Naphthofuran - Alpha-amino acid or derivatives - Amphetamine or derivatives - Phenol ester - Tetralin - Dimethoxybenzene - M-dimethoxybenzene - Benzodioxole - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Fatty acid ester - Phenol - Fatty acyl - Benzenoid - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Gamma butyrolactone - Piperidine - Oxolane - Carbamic acid ester - Lactone - Carboxylic acid ester - Azacycle - Oxacycle - Ether - Acetal - Carboxylic acid derivative - Organoheterocyclic compound - Organic oxide - Organic oxygen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organopnictogen compound - Hydrocarbon derivative - Organic nitrogen 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