Compound Identification
SMILES
CC12CCC3C4(C)CCC(O)CC44C=CC3(C1CCC2(O)CN1CCC2=C(C1)NC1=CC=CC=C21)C(=C4)C(=O)CC1=C(F)C=CC=C1Cl
InChIKey
InChIKey=YIVFJSKBZQXXMF-UHFFFAOYSA-N
Formula
C41H46ClFN2O3
Mass
669.28
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
3-alkylindoles Aralkylamines Fluorobenzenes Chlorobenzenes Aryl chlorides Aryl fluorides Tertiary alcohols Pyrroles Heteroaromatic compounds Trialkylamines Secondary alcohols 1,2-aminoalcohols Ketones Cyclic alcohols and derivatives Azacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides Organofluorides Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Beta-carboline - 3-alkylindole - Indole - Halobenzene - Fluorobenzene - Aralkylamine - Chlorobenzene - Aryl chloride - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Cyclic alcohol - Pyrrole - Tertiary alcohol - Tertiary aliphatic amine - Ketone - Tertiary amine - 1,2-aminoalcohol - Secondary alcohol - Azacycle - Organic nitrogen compound - Organohalogen compound - Organochloride - Organofluoride - Organonitrogen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Amine - Alcohol - 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