Compound Identification
SMILES
COC(=O)[C@@]1(CO)[C@H]2CCN(CC2=CC)CC2=C1NC1=CC=CC=C21
InChIKey
InChIKey=JZKSIYFJGCTTET-JXFKEZNVSA-N
Formula
C20H24N2O3
Mass
340.423
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
- Class Vallesaman alkaloids
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Vallesaman alkaloids
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Vallesaman alkaloids
Alternative Parents
3-alkylindoles Aralkylamines Beta hydroxy acids and derivatives Benzenoids Piperidines Methyl esters Heteroaromatic compounds Pyrroles Trialkylamines Amino acids and derivatives Monocarboxylic acids and derivatives Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Primary alcohols Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Vallesaman-skeleton - 3-alkylindole - Indole - Indole or derivatives - Beta-hydroxy acid - Aralkylamine - Hydroxy acid - Piperidine - Benzenoid - Heteroaromatic compound - Pyrrole - Methyl ester - Amino acid or derivatives - Carboxylic acid ester - Tertiary amine - Tertiary aliphatic amine - Azacycle - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - Carbonyl group - Organic nitrogen compound - Primary alcohol - Alcohol - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as vallesaman alkaloids. These are alkaloids with a structure that is based on the vallesaman skeleton, a tetracyclic compound that contains a piperidine ring fused to an indole.
External Descriptors
Not available