Compound Identification
SMILES
Cl.O=C(N1CCC2(CC1)N[C@H](CC1=C2NC2=CC=CC=C12)C1=NC=C(N1)C1=CC=CC=C1)C1=CC=CC=C1
InChIKey
InChIKey=PBLCPSDLJNMXDZ-UFTMZEDQSA-N
Formula
C31H30ClN5O
Mass
524.07
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
- Class Harmala alkaloids
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Harmala alkaloids
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Harmala alkaloids
Alternative Parents
N-benzoylpiperidines Beta carbolines Phenylimidazoles 3-alkylindoles Benzamides Benzoyl derivatives Aralkylamines Tertiary carboxylic acid amides Pyrroles Heteroaromatic compounds Amino acids and derivatives Azacyclic compounds Dialkylamines Hydrochlorides Organic oxides Organooxygen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-benzoylpiperidine - Harman - Pyridoindole - Beta-carboline - 5-phenylimidazole - 4-phenylimidazole - 3-alkylindole - N-acyl-piperidine - Benzoic acid or derivatives - Benzamide - Indole - Indole or derivatives - Benzoyl - Aralkylamine - Benzenoid - Piperidine - Monocyclic benzene moiety - Heteroaromatic compound - Tertiary carboxylic acid amide - Imidazole - Pyrrole - Azole - Amino acid or derivatives - Carboxamide group - Secondary amine - Organoheterocyclic compound - Secondary aliphatic amine - Carboxylic acid derivative - Azacycle - Amine - Hydrochloride - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as harmala alkaloids. These are compounds with a structure based on harmaline, harmine, harmalol, harman or a derivative of those parents. These parents are beta-carbolines, consisting of a pyrimidine fused to the pyrrole moiety of an indole to form a pyrido[3,4-b]indole.
External Descriptors
Not available