Compound Identification
SMILES
CC1=CC(CC2=NC(=O)N=C(NC3=CC(NC4=C5C(=O)C6=CC=CC=C6C6=NC=CC(C=C4)=C56)=C(C)C=C3)N2)=C(C)C=C1
InChIKey
InChIKey=NLKJYTULUXXBAA-UHFFFAOYSA-N
Formula
C35H28N6O2
Mass
564.649
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 Diaminotoluenes p-Xylenes Aniline and substituted anilines Aryl ketones Aminotriazines Triazinones 1,3,5-triazines Pyridines and derivatives Primary aromatic amines Vinylogous amides Heteroaromatic compounds Azacyclic compounds Secondary amines Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
7-oxoisoaporphine - Anthracene - Isoquinoline - Diaminotoluene - P-xylene - Xylene - Aryl ketone - Aminotoluene - Aniline or substituted anilines - Amino-1,3,5-triazine - Aminotriazine - Toluene - Triazinone - Monocyclic benzene moiety - Primary aromatic amine - Pyridine - Triazine - Benzenoid - 1,3,5-triazine - Heteroaromatic compound - Vinylogous amide - Ketone - Secondary amine - Azacycle - Organoheterocyclic compound - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Amine - 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