Compound Identification
SMILES
CN1C2=CC=CC=C2C2=C1\C(NCC2)=C1/CCCOC1=O
InChIKey
InChIKey=NHRGTMJOUPMJEH-SQFISAMPSA-N
Formula
C17H18N2O2
Mass
282.343
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
Beta carbolines 3-alkylindoles N-alkylindoles Aralkylamines Delta valerolactones N-methylpyrroles Benzenoids Oxanes Heteroaromatic compounds Enoate esters Vinylogous amides Monocarboxylic acids and derivatives Enamines Dialkylamines Azacyclic compounds Oxacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Harman - Beta-carboline - Pyridoindole - N-alkylindole - 3-alkylindole - Indole - Indole or derivatives - Delta valerolactone - Delta_valerolactone - Aralkylamine - N-methylpyrrole - Oxane - Substituted pyrrole - Benzenoid - Vinylogous amide - Alpha,beta-unsaturated carboxylic ester - Pyrrole - Enoate ester - Heteroaromatic compound - Carboxylic acid ester - Lactone - Monocarboxylic acid or derivatives - Oxacycle - Enamine - Secondary aliphatic amine - Organoheterocyclic compound - Carboxylic acid derivative - Azacycle - Amine - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen 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