Compound Identification
SMILES
COC1=C(OC)C2=C(CC(=O)C3=CC4=C(OCO4)C=C3CCN(CC3=CC=CC=C3)C2)C=C1
InChIKey
InChIKey=XEXCJRMCALAGQQ-UHFFFAOYSA-N
Formula
C27H27NO5
Mass
445.515
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
- Class Protopine alkaloids
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Protopine alkaloids
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Protopine alkaloids
Alternative Parents
Benzodioxoles Phenylmethylamines Benzylamines Aryl alkyl ketones Anisoles Aralkylamines Alkyl aryl ethers Trialkylamines Oxacyclic compounds Azacyclic compounds Acetals Organopnictogen compounds Organic oxides Hydrocarbon derivatives Aldehydes
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Protopine skeleton - Benzodioxole - Anisole - Benzylamine - Phenylmethylamine - Aryl ketone - Aryl alkyl ketone - Aralkylamine - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Tertiary aliphatic amine - Tertiary amine - Ketone - Organoheterocyclic compound - Oxacycle - Azacycle - Acetal - Ether - Organopnictogen compound - Organonitrogen compound - Aldehyde - Organooxygen compound - Organic nitrogen compound - Amine - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as protopine alkaloids. These are alkaloids with a structure based on a tricyclic protopine formed by oxidative ring fission of protoberberine N-metho salts.
External Descriptors
Not available