Compound Identification
SMILES
[H+].CC[N+]1=C2C3=CC4=C(OCO4)C=C3C=CC2=C2C=CC(OC)=C(O)C2=C1
InChIKey
InChIKey=TXDLZJFVDWGURX-UHFFFAOYSA-P
Formula
C21H19NO4
Mass
349.385
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Benzophenanthridine alkaloids
Subclass
N-demethylbenzophenanthridine alkaloids
Intermediate Tree Nodes
Not available
Direct Parent
N-demethylbenzophenanthridine alkaloids
Alternative Parents
Phenanthridines and derivatives Naphthalenes Isoquinolines and derivatives Benzodioxoles Anisoles 1-hydroxy-4-unsubstituted benzenoids Alkyl aryl ethers Pyridinium derivatives Heteroaromatic compounds Oxacyclic compounds Acetals Azacyclic compounds Organonitrogen compounds Organopnictogen compounds Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-demethylbenzophenanthridine alkaloid skeleton - Benzoquinoline - Phenanthridine - Isoquinoline - Naphthalene - Quinoline - Benzodioxole - Anisole - Alkyl aryl ether - 1-hydroxy-4-unsubstituted benzenoid - Benzenoid - Pyridinium - Pyridine - Heteroaromatic compound - Acetal - Ether - Oxacycle - Azacycle - Organoheterocyclic compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organopnictogen compound - Organonitrogen compound - Organooxygen compound - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as n-demethylbenzophenanthridine alkaloids. These are alkaloids containing a N-demethylbenzophenanthridine skeleton, which consists of a benzene ring fused to one benzene moiety of the tricyclic phenanthiridine system. These compounds do not carry a methyl group at the N-atom of the phenanthridine moiety, in contrast to other benzophenanthridine alkaloids.
External Descriptors
Not available