Compound Identification
SMILES
COC1=CC(=CC(OC)=C1O)[C@H]1[C@@H]2[C@H](COC2=O)[C@H](NC(=O)C2=CC(OC)=C(Br)C(OC)=C2)C2=CC3=C(OCO3)C=C12
InChIKey
InChIKey=MEIOFXSDBSCEDA-KBRRSMIASA-N
Formula
C30H28BrNO10
Mass
642.455
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 4-halobenzoic acids and derivatives Dimethoxybenzenes Methoxyphenols Benzamides Benzodioxoles Anisoles Phenoxy compounds Benzoyl derivatives Alkyl aryl ethers Bromobenzenes Aryl bromides Gamma butyrolactones Oxolanes Carboxylic acid esters Secondary carboxylic acid amides Acetals Monocarboxylic acids and derivatives Oxacyclic compounds Carbonyl compounds Organobromides Hydrocarbon derivatives Organopnictogen compounds Organonitrogen compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Lignan lactone - Tametraline - 1-aryltetralin lignan - Linear furanonaphthodioxole - Naphthofuran - Methoxyphenol - Tetralin - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Dimethoxybenzene - M-dimethoxybenzene - Benzoic acid or derivatives - Benzodioxole - Benzamide - Methoxybenzene - Phenoxy compound - Benzoyl - Anisole - Phenol ether - Halobenzene - Bromobenzene - Alkyl aryl ether - Phenol - Monocyclic benzene moiety - Benzenoid - Aryl halide - Aryl bromide - Gamma butyrolactone - Oxolane - Carboxamide group - Lactone - Carboxylic acid ester - Secondary carboxylic acid amide - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Acetal - Ether - Oxacycle - Organoheterocyclic compound - Organic nitrogen compound - Carbonyl group - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen 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