Compound Identification
SMILES
COC(=O)C1=C2NC3=C(C=CC(OC)=C3)C22CCN3CC4OC4C(C1)(C(C)O)C23
InChIKey
InChIKey=JHLKAIJXPRFWJH-UHFFFAOYSA-N
Formula
C22H26N2O5
Mass
398.459
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Aspidospermatan-type alkaloids
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Aspidospermatan-type alkaloids
Alternative Parents
Carbazoles Indolines Indolizidines Anisoles Epoxypiperidines Secondary alkylarylamines Alkyl aryl ethers 1,4-oxazepines Aralkylamines Piperidines N-alkylpyrrolidines 1,3-aminoalcohols Vinylogous amides Methyl esters Enoate esters Amino acids and derivatives Secondary alcohols Trialkylamines Dialkyl ethers Enamines Epoxides Azacyclic compounds Monocarboxylic acids and derivatives Oxacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Aspidosperma alkaloid - Carbazole - Indolizidine - Dihydroindole - Indole or derivatives - Anisole - Para-oxazepine - Alkyl aryl ether - Secondary aliphatic/aromatic amine - Epoxypiperidine - Aralkylamine - N-alkylpyrrolidine - Piperidine - Benzenoid - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Methyl ester - 1,3-aminoalcohol - Vinylogous amide - Pyrrolidine - Tertiary aliphatic amine - Tertiary amine - Secondary alcohol - Carboxylic acid ester - Amino acid or derivatives - Oxacycle - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Dialkyl ether - Enamine - Oxirane - Secondary amine - Ether - Monocarboxylic acid or derivatives - Carbonyl group - Alcohol - Organopnictogen compound - Amine - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as aspidospermatan-type alkaloids. These are tryptophan-derived alkaloids that are derived from the fusion of tryptamine and a terpene unit (generally either 9 or 10 carbons). Aspidospermine and aspidospermidine (along with tabersonine) are the archetypical members of the Aspidosperma alkaloids.
External Descriptors
Not available