Compound Identification
SMILES
COC(=O)[C@]12CC[C@]34CCCN5CC(C(=O)C3)[C@@]1([C@H]45)C1=C(N2)C2=C(OCO2)C=C1
InChIKey
InChIKey=HJIKLBGXTXSUFC-OBQXXSJKSA-N
Formula
C22H24N2O5
Mass
396.443
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 Benzodioxoles Indolines Indolizidines Aralkylamines Secondary alkylarylamines Azepanes N-alkylpyrrolidines Piperidines Benzenoids Methyl esters Trialkylamines Ketones Oxacyclic compounds Azacyclic compounds Acetals Monocarboxylic acids and derivatives Organic oxides Organopnictogen compounds Hydrocarbon derivatives Aldehydes
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Aspidofractine skeleton - Aspidosperma alkaloid - Alpha-amino acid ester - Carbazole - Indolecarboxylic acid - Indolecarboxylic acid derivative - Alpha-amino acid or derivatives - Quinolidine - Benzodioxole - Indole or derivatives - Dihydroindole - Indolizidine - Azepane - Aralkylamine - Secondary aliphatic/aromatic amine - Benzenoid - N-alkylpyrrolidine - Piperidine - Pyrrolidine - Methyl ester - Tertiary amine - Tertiary aliphatic amine - Amino acid or derivatives - Carboxylic acid ester - Ketone - Secondary amine - Oxacycle - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Azacycle - Organoheterocyclic compound - Acetal - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Carbonyl group - Organooxygen compound - Organic oxygen compound - Amine - Organonitrogen compound - Aldehyde - 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