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=WVAGUIWSJPKCHA-FBCFKRBSSA-N
Formula
C21H28N2O4
Mass
372.465
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 Aralkylamines Benzenoids Pyrroles 1,3-aminoalcohols Methyl esters Heteroaromatic compounds Trialkylamines Secondary alcohols Amino acids and derivatives Monocarboxylic acids and derivatives Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Ervatamia skeleton - 3-alkylindole - Indole - Indole or derivatives - Piperidinecarboxylic acid - Aralkylamine - Piperidine - Benzenoid - 1,3-aminoalcohol - Pyrrole - Methyl ester - Heteroaromatic compound - Tertiary aliphatic amine - Tertiary amine - Secondary alcohol - Amino acid or derivatives - Carboxylic acid ester - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Alcohol - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Carbonyl group - Amine - Organic oxide - 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