Compound Identification
SMILES
Cl.COC1=CC(=CC(OC)=C1O)[C@@H]1[C@@H]2C(COC2=O)[C@H](NCCN2CCOCC2)C2=CC3=C(OCO3)C=C12
InChIKey
InChIKey=MHTBGZOLKFEGKU-WWXLJHPUSA-N
Formula
C27H33ClN2O8
Mass
549.02
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 Benzodioxoles Phenoxy compounds Anisoles Alkyl aryl ethers Aralkylamines Morpholines Gamma butyrolactones Oxolanes Trialkylamines Carboxylic acid esters Amino acids and derivatives Monocarboxylic acids and derivatives Acetals Dialkylamines Dialkyl ethers Azacyclic compounds Oxacyclic compounds Carbonyl compounds Organic oxides Organopnictogen compounds Hydrocarbon derivatives Hydrochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Lignan lactone - Tametraline - 1-aryltetralin lignan - Linear furanonaphthodioxole - Naphthofuran - Methoxyphenol - Tetralin - Dimethoxybenzene - M-dimethoxybenzene - Benzodioxole - Methoxybenzene - Phenol ether - Phenoxy compound - Anisole - Alkyl aryl ether - Phenol - Aralkylamine - Benzenoid - Monocyclic benzene moiety - Oxazinane - Morpholine - Gamma butyrolactone - Oxolane - Tertiary aliphatic amine - Tertiary amine - Amino acid or derivatives - Lactone - Carboxylic acid ester - Acetal - Carboxylic acid derivative - Oxacycle - Dialkyl ether - Secondary aliphatic amine - Ether - Azacycle - Organoheterocyclic compound - Secondary amine - Monocarboxylic acid or derivatives - Amine - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrochloride - Hydrocarbon derivative - Carbonyl group - Organic nitrogen compound - Organooxygen 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