Compound Identification
SMILES
COC1=C(Br)C2=C3C(=CC=C2)C(=O)C2=CC=CC=C2C3=N1
InChIKey
InChIKey=HADMDFNIROMYBX-UHFFFAOYSA-N
Formula
C17H10BrNO2
Mass
340.176
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 Aryl ketones Alkyl aryl ethers Pyridines and derivatives Aryl bromides Heteroaromatic compounds Azacyclic compounds Organonitrogen compounds Organobromides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
7-oxoisoaporphine - Anthracene - Isoquinoline - Aryl ketone - Alkyl aryl ether - Aryl bromide - Aryl halide - Benzenoid - Pyridine - Heteroaromatic compound - Ketone - Ether - Azacycle - Organoheterocyclic compound - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organobromide - Organonitrogen compound - Organooxygen 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