Compound Identification
SMILES
CCOC(=O)C1=C2C3=CC=CC=C3C3=CC=CC=C3C2=CC2=[N+]1CCC1=CC=CC=C21
InChIKey
InChIKey=DIVJVPWHSSAIPN-UHFFFAOYSA-N
Formula
C28H22NO2
Mass
404.488
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Protoberberine alkaloids and derivatives
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Protoberberine alkaloids and derivatives
Alternative Parents
Phenanthrenes and derivatives Naphthalenes Isoquinolines and derivatives Pyridinecarboxylic acids Pyridinium derivatives Heteroaromatic compounds Carboxylic acid esters Azacyclic compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Protoberberine skeleton - Phenanthrene - Isoquinoline - Naphthalene - Pyridine carboxylic acid - Pyridine carboxylic acid or derivatives - Benzenoid - Pyridinium - Pyridine - Heteroaromatic compound - Carboxylic acid ester - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as protoberberine alkaloids and derivatives. These are alkaloids with a structure based on a protoberberine moiety, which consists of a 5,6-dihydrodibenzene moiety fused to a quinolizinium and forming 5,6-Dihydrodibenzo(a,g)quinolizinium skeleton.
External Descriptors
Not available