Compound Identification
SMILES
COC(=O)[C@]12CC[C@]34CCCN5C[C@H](C(=O)C3)[C@@]1([C@H]45)C1=C(N2)C(OC)=CC=C1
InChIKey
InChIKey=DURZPTVMWVJYBB-RXPWAHTNSA-N
Formula
C22H26N2O4
Mass
382.46
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
- Class Aspidofractine alkaloids
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Aspidofractine alkaloids
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Aspidofractine alkaloids
Alternative Parents
Aspidospermatan-type alkaloids Alpha amino acid esters Carbazoles Indolecarboxylic acids Quinolidines Indolizidines Indolines Anisoles Alkyl aryl ethers Secondary alkylarylamines Aralkylamines Azepanes Piperidines N-alkylpyrrolidines Methyl esters Trialkylamines Ketones Azacyclic compounds Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Aspidofractine skeleton - Aspidosperma alkaloid - Carbazole - Alpha-amino acid ester - Indolecarboxylic acid - Indolecarboxylic acid derivative - Alpha-amino acid or derivatives - Quinolidine - Indole or derivatives - Dihydroindole - Indolizidine - Phenol ether - Anisole - Alkyl aryl ether - Secondary aliphatic/aromatic amine - Aralkylamine - Azepane - Benzenoid - N-alkylpyrrolidine - Piperidine - Methyl ester - Pyrrolidine - Tertiary aliphatic amine - Tertiary amine - Carboxylic acid ester - Amino acid or derivatives - Ketone - Organoheterocyclic compound - Azacycle - Secondary amine - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Ether - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Amine - Organic oxide - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as aspidofractine alkaloids. These are alkaloids with a structure that is based on the hexacyclic aspidofractine core. These compounds are related to the Aspidosperma group by formation of a C-2 to C-18 bond.
External Descriptors
Not available