Compound Identification
SMILES
CCC(C)(C)C1=CC(C)=C(OC2=C3C=CN=C4C5=C(C(NC6=C(C)C=C(C)C=C6)=CC=C5)C(=O)C(C=C2)=C34)C=C1
InChIKey
InChIKey=IMYYZTRCSSSQLK-UHFFFAOYSA-N
Formula
C36H34N2O2
Mass
526.68
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 Diarylethers Isoquinolines and derivatives Phenylpropanes Aniline and substituted anilines m-Xylenes Aryl ketones Phenol ethers Phenoxy compounds Toluenes Primary aromatic amines Pyridines and derivatives Heteroaromatic compounds Vinylogous amides Azacyclic compounds Secondary amines Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
7-oxoisoaporphine - Anthracene - Diaryl ether - Isoquinoline - Phenylpropane - Aryl ketone - Phenoxy compound - Aniline or substituted anilines - Phenol ether - M-xylene - Xylene - Toluene - Primary aromatic amine - Monocyclic benzene moiety - Benzenoid - Pyridine - Heteroaromatic compound - Vinylogous amide - Ketone - Organoheterocyclic compound - Azacycle - Ether - Secondary amine - Organooxygen compound - Organonitrogen compound - Amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - 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