Compound Identification
SMILES
COCC1=C2C(NC3=C2C(OCCCN2CCC(CC2)C(=O)C2=CC=C(F)C=C2)=CC=C3)=CN=C1C(=O)OC(C)C
InChIKey
InChIKey=DPVNQTYGJTVCLO-UHFFFAOYSA-N
Formula
C32H36FN3O5
Mass
561.654
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
-
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
Alkyl-phenylketones Pyridinecarboxylic acids Indoles Phenol ethers Aryl alkyl ketones Benzoyl derivatives Alkyl aryl ethers Fluorobenzenes Piperidines Gamma-amino ketones Aryl fluorides Pyrroles Heteroaromatic compounds Trialkylamines Amino acids and derivatives Carboxylic acid esters Dialkyl ethers Azacyclic compounds Hydrocarbon derivatives Organofluorides Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - Beta-carboline - Indole - Phenylketone - Pyridine carboxylic acid - Pyridine carboxylic acid or derivatives - Phenol ether - Benzoyl - Aryl alkyl ketone - Aryl ketone - Alkyl aryl ether - Halobenzene - Fluorobenzene - Aryl fluoride - Aryl halide - Pyridine - Benzenoid - Piperidine - Monocyclic benzene moiety - Gamma-aminoketone - Heteroaromatic compound - Pyrrole - Amino acid or derivatives - Tertiary aliphatic amine - Carboxylic acid ester - Tertiary amine - Ketone - Ether - Dialkyl ether - Carboxylic acid derivative - Azacycle - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organofluoride - Organic oxygen compound - Organohalogen 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