Compound Identification
SMILES
NCC1CCCC(CNC(=O)C2CC3=C(CN2C2=CC=C(OC4=CC=C(C=C4)C(F)(F)F)C=C2)NC2=CC=CC=C32)C1
InChIKey
InChIKey=JCEHZKCLHAOBGH-UHFFFAOYSA-N
Formula
C33H35F3N4O2
Mass
576.664
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
Diphenylethers Alpha amino acid amides Diarylethers Trifluoromethylbenzenes 3-alkylindoles Phenoxy compounds Phenol ethers Aniline and substituted anilines Dialkylarylamines Aralkylamines Pyrroles Heteroaromatic compounds Secondary carboxylic acid amides Azacyclic compounds Monoalkylamines Carbonyl compounds Organic oxides Organofluorides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Beta-carboline - Diphenylether - Alpha-amino acid amide - Diaryl ether - Alpha-amino acid or derivatives - Trifluoromethylbenzene - 3-alkylindole - Indole - Phenoxy compound - Phenol ether - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Aralkylamine - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - Pyrrole - Tertiary amine - Secondary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Azacycle - Carboxylic acid derivative - Ether - Organic nitrogen compound - Hydrocarbon derivative - Primary aliphatic amine - Organic oxide - Organohalogen compound - Organofluoride - Carbonyl group - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Alkyl halide - Primary amine - Alkyl fluoride - Amine - 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