Compound Identification
SMILES
CCOC(=O)C1=CC=C(N[C@H]2[C@H]3COC(=O)[C@@H]3[C@H](C3=CC(OC)=C(O)C(OC)=C3)C3=CC(OC)=C(OC)C=C23)C=C1
InChIKey
InChIKey=BWOFWMGBPOUISW-GVQBMFDGSA-N
Formula
C31H33NO9
Mass
563.603
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 Naphthofurans Aminobenzoic acids and derivatives Methoxyphenols Benzoic acid esters Dimethoxybenzenes Phenylalkylamines Phenoxy compounds Aniline and substituted anilines Anisoles Benzoyl derivatives Alkyl aryl ethers Secondary alkylarylamines Gamma butyrolactones Dicarboxylic acids and derivatives Tetrahydrofurans Amino acids and derivatives Carboxylic acid esters Oxacyclic compounds Hydrocarbon derivatives Organic oxides Organopnictogen compounds Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Lignan lactone - Tametraline - 1-aryltetralin lignan - Naphthofuran - Aminobenzoic acid or derivatives - Benzoate ester - Methoxyphenol - M-dimethoxybenzene - Dimethoxybenzene - Tetralin - Benzoic acid or derivatives - Anisole - Phenoxy compound - Benzoyl - Phenol ether - Methoxybenzene - Phenylalkylamine - Aniline or substituted anilines - Aralkylamine - Secondary aliphatic/aromatic amine - Phenol - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Dicarboxylic acid or derivatives - Gamma butyrolactone - Tetrahydrofuran - Lactone - Carboxylic acid ester - Amino acid or derivatives - Secondary amine - Organoheterocyclic compound - Ether - Oxacycle - Carboxylic acid derivative - Organic oxide - Carbonyl group - Organic oxygen compound - Amine - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organopnictogen 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