Compound Identification
SMILES
CCC(C)(C)C1=CC=C(OC2=C3C=CN=C4C5=CC=CC=C5C(=O)C(C=C2)=C34)C=C1
InChIKey
InChIKey=AXYRIEMCYPMFIG-UHFFFAOYSA-N
Formula
C27H23NO2
Mass
393.486
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 Phenoxy compounds Phenol ethers Aryl ketones Pyridines and derivatives Heteroaromatic compounds Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
7-oxoisoaporphine - Anthracene - Diaryl ether - Isoquinoline - Phenylpropane - Phenoxy compound - Phenol ether - Aryl ketone - Monocyclic benzene moiety - Pyridine - Benzenoid - Heteroaromatic compound - Ketone - Ether - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - 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