Compound Identification
SMILES
COC(=O)[C@@]12CN(C)C[C@H]([C@@H](C)O)[C@@H]1CC(=O)C1=C(C2)C2=CC=CC=C2N1
InChIKey
InChIKey=QLRBMJJPXBETJJ-HGTOXVDESA-N
Formula
C21H26N2O4
Mass
370.449
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
- Class Ervatamia alkaloids
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Ervatamia alkaloids
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Ervatamia alkaloids
Alternative Parents
3-alkylindoles Piperidinecarboxylic acids Aryl alkyl ketones Aralkylamines Benzenoids Methyl esters Heteroaromatic compounds 1,3-aminoalcohols Pyrroles Secondary alcohols Amino acids and derivatives Trialkylamines Monocarboxylic acids and derivatives Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Ervatamia skeleton - 3-alkylindole - Indole - Indole or derivatives - Piperidinecarboxylic acid - Aryl alkyl ketone - Aryl ketone - Aralkylamine - Piperidine - Benzenoid - 1,3-aminoalcohol - Heteroaromatic compound - Pyrrole - Methyl ester - Ketone - Carboxylic acid ester - Amino acid or derivatives - Secondary alcohol - Tertiary aliphatic amine - Tertiary amine - Azacycle - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organoheterocyclic compound - Organic oxide - Alcohol - Organonitrogen compound - Organooxygen compound - Amine - Carbonyl group - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as ervatamia alkaloids. These are alkaloids with a structure based on the tetracyclic ervatamia skeleton, which arises from the 5,6- bond cleavage and 6,16- bond formation in the vobasine skeleton.
External Descriptors
Not available