Compound Identification
SMILES
COC(=O)C12C3CC4(C1OC(=O)c1cc(OC)c(OC)c(OC)c1)C(C1CC2C(CN31)=CC)N(C)c1ccccc41
InChIKey
InChIKey=IFFBQMRDVLQSPU-UHFFFAOYSA-N
Formula
C32H36N2O7
Mass
560.647
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Corynanthean-type alkaloids
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Corynanthean-type alkaloids
Alternative Parents
Beta carbolines Gallic acid and derivatives M-methoxybenzoic acids and derivatives P-methoxybenzoic acids and derivatives Benzoic acid esters Quinolizidines Piperidinecarboxylic acids Phenoxy compounds Methoxybenzenes Anisoles Quinuclidines Dialkylarylamines Benzoyl derivatives Aralkylamines Alkyl aryl ethers Azepanes Dicarboxylic acids and derivatives Methyl esters Amino acids and derivatives Trialkylamines Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Corynanthean skeleton - Pyridoindole - Beta-carboline - Gallic acid or derivatives - P-methoxybenzoic acid or derivatives - M-methoxybenzoic acid or derivatives - Quinolizidine - Benzoate ester - Piperidinecarboxylic acid - Benzoic acid or derivatives - Indole or derivatives - Dialkylarylamine - Anisole - Tertiary aliphatic/aromatic amine - Quinuclidine - Phenol ether - Phenoxy compound - Methoxybenzene - Benzoyl - Aralkylamine - Azepane - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Dicarboxylic acid or derivatives - Piperidine - Methyl ester - Tertiary aliphatic amine - Tertiary amine - Amino acid or derivatives - Carboxylic acid ester - Ether - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organopnictogen compound - Organonitrogen compound - Carbonyl group - Organic oxygen compound - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as corynanthean-type alkaloids. These are alkaloids with a structure based on the corynanthean nucleus, which is a tetracycle characterized by an indole fused to a quinolizidine. Additionally, the quinolizidine ring system is substituted to a 2-methylpropyl group and one ethyl group.
External Descriptors
Not available