Compound Identification
SMILES
[O-][N+](=O)C1=C(N=CN=C1N(CCC#N)CC1=CC=CO1)N1CCC2=C(C1)NC1=CC=CC=C21
InChIKey
InChIKey=VMKRKEQNVQRKDY-UHFFFAOYSA-N
Formula
C23H21N7O3
Mass
443.467
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Indoles and derivatives
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Subclass
Pyridoindoles
- Level 5 Beta carbolines
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Subclass
Pyridoindoles
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Class
Indoles and derivatives
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Indoles and derivatives
Subclass
Pyridoindoles
Intermediate Tree Nodes
Not available
Direct Parent
Beta carbolines
Alternative Parents
3-alkylindoles Pyridopyrimidines Dialkylarylamines Nitroaromatic compounds Aminopyrimidines and derivatives Benzenoids Imidolactams Pyrroles Furans Heteroaromatic compounds Nitriles Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Organic oxoazanium compounds Organic zwitterions Hydrocarbon derivatives Organooxygen compounds Organic salts Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Beta-carboline - Pyridopyrimidine - 3-alkylindole - Indole - Nitroaromatic compound - Dialkylarylamine - Aminopyrimidine - Pyrimidine - Imidolactam - Benzenoid - Furan - Heteroaromatic compound - Pyrrole - C-nitro compound - Organic nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carbonitrile - Nitrile - Organic oxoazanium - Oxacycle - Azacycle - Allyl-type 1,3-dipolar organic compound - Organonitrogen compound - Cyanide - Amine - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organic zwitterion - Organic salt - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as beta carbolines. These are compounds containing a 9H-pyrido[3,4-b]indole moiety.
External Descriptors
Not available