Compound Identification
SMILES
COC1=CC(=CC(OC)=C1O)C1[C@@H]2C(COC2=O)[C@H](NC2=CC=C(C=C2)[N+]([O-])=O)C2=CC3=C(OCO3)C=C12
InChIKey
InChIKey=DLROLUIVVKTFPW-PUEOPUMLSA-N
Formula
C27H24N2O9
Mass
520.494
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 Dimethoxybenzenes Methoxyphenols Nitrobenzenes Benzodioxoles Nitroaromatic compounds Phenylalkylamines Phenoxy compounds Anisoles Aniline and substituted anilines Secondary alkylarylamines Alkyl aryl ethers Gamma butyrolactones Tetrahydrofurans Amino acids and derivatives Carboxylic acid esters Acetals Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Organic oxoazanium compounds Monocarboxylic acids and derivatives Organopnictogen compounds Organic oxides Carbonyl compounds Organic zwitterions Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Lignan lactone - Tametraline - 1-aryltetralin lignan - Linear furanonaphthodioxole - Naphthofuran - Tetralin - Dimethoxybenzene - M-dimethoxybenzene - Methoxyphenol - Nitrobenzene - Benzodioxole - Phenylalkylamine - Aniline or substituted anilines - Anisole - Phenol ether - Nitroaromatic compound - Phenoxy compound - Methoxybenzene - Aralkylamine - Alkyl aryl ether - Phenol - Secondary aliphatic/aromatic amine - Monocyclic benzene moiety - Benzenoid - 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 - Acetal - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Organic 1,3-dipolar compound - Organic oxoazanium - Organooxygen compound - Hydrocarbon derivative - Amine - Organopnictogen compound - Organic oxide - Carbonyl group - Organic oxygen compound - Organic zwitterion - 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