Compound Identification
SMILES
COC1=CC(=CC(OC)=C1O)[C@H]1[C@@H]2[C@H](COC2=O)[C@H](NC2=CC=C(C=C2)[N+]([O-])=O)C2=CC(OC)=C(OC)C=C12
InChIKey
InChIKey=ADFKUAKREZUYMC-QNMIOERPSA-N
Formula
C28H28N2O9
Mass
536.537
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 Dimethoxybenzenes Methoxyphenols Nitrobenzenes Phenylalkylamines Phenoxy compounds Aniline and substituted anilines Anisoles Nitroaromatic compounds Secondary alkylarylamines Alkyl aryl ethers Gamma butyrolactones Tetrahydrofurans Amino acids and derivatives Carboxylic acid esters Organic oxoazanium compounds Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Monocarboxylic acids and derivatives Organic oxides Carbonyl compounds Organic zwitterions Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Lignan lactone - Tametraline - 1-aryltetralin lignan - Naphthofuran - Tetralin - Dimethoxybenzene - M-dimethoxybenzene - Methoxyphenol - Nitrobenzene - Phenoxy compound - Phenol ether - Nitroaromatic compound - Anisole - Aniline or substituted anilines - Phenylalkylamine - Methoxybenzene - Secondary aliphatic/aromatic amine - Aralkylamine - Phenol - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Gamma butyrolactone - Tetrahydrofuran - Amino acid or derivatives - Carboxylic acid ester - Lactone - Organic nitro compound - C-nitro compound - Secondary amine - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Ether - Oxacycle - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Organic 1,3-dipolar compound - Organic oxoazanium - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Carbonyl group - Amine - Organopnictogen compound - Organic zwitterion - Organonitrogen compound - 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