Compound Identification
SMILES
CCC(C)(C)C1=CC=C(NC2=C(OC)N=C3C4=CC=CC=C4C(=O)C4=CC=CC2=C34)C=C1
InChIKey
InChIKey=YJJVUULTZVDHOW-UHFFFAOYSA-N
Formula
C28H26N2O2
Mass
422.528
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
-
Class
Isoaporphines
- Subclass Oxoisoaporphines
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Class
Isoaporphines
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Isoaporphines
Subclass
Oxoisoaporphines
Intermediate Tree Nodes
Not available
Direct Parent
Oxoisoaporphines
Alternative Parents
Anthracenes Isoquinolines and derivatives Phenylpropanes Aryl ketones Aniline and substituted anilines Aminopyridines and derivatives Alkyl aryl ethers Primary aromatic amines Heteroaromatic compounds Secondary amines Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
7-oxoisoaporphine - Anthracene - Isoquinoline - Phenylpropane - Aryl ketone - Aniline or substituted anilines - Alkyl aryl ether - Aminopyridine - Monocyclic benzene moiety - Primary aromatic amine - Pyridine - Benzenoid - Heteroaromatic compound - Ketone - Ether - Secondary amine - Azacycle - Organoheterocyclic compound - Organic oxygen compound - Amine - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as oxoisoaporphines. These are alkaloids with a structure that contains the isoaporphine skeleton with an oxo group at the 7-position.
External Descriptors
Not available