Structure Information
Structure

Compound Identification

SMILES

CCN1C[C@]2(COC(=O)C3=CC=CC=C3NC(C)=O)CC[C@H](OC)[C@@]34[C@@H]2C[C@@](O)(C13)[C@@]1(O)C[C@H](OC)[C@H]2C[C@]4(O)[C@]1(O)[C@H]2OC

InChIKey

InChIKey=IUJWSEFNAUXHTB-PEOOALOTSA-N

Formula

C33H46N2O10

Mass

630.735

Export to:

JSON SDF CSV

Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Prenol lipids

Subclass

Diterpenoids

Intermediate Tree Nodes

Not available

Direct Parent

Aconitane-type diterpenoid alkaloids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Aconitane-type diterpenoid alkaloid - Acylaminobenzoic acid or derivatives - Acetanilide - Benzoate ester - Quinolidine - N-acetylarylamine - Benzoic acid or derivatives - Alkaloid or derivatives - Anilide - Benzoyl - N-arylamide - Azepane - Piperidine - Monocyclic benzene moiety - Benzenoid - Cyclic alcohol - Tertiary alcohol - Acetamide - Vinylogous amide - Carboxylic acid ester - Secondary carboxylic acid amide - Amino acid or derivatives - Tertiary amine - Tertiary aliphatic amine - Carboxamide group - 1,2-aminoalcohol - Azacycle - Organoheterocyclic compound - Polyol - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Dialkyl ether - Ether - Amine - Alcohol - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Organooxygen compound - Organic oxygen compound - Organonitrogen compound - Organopnictogen compound - Organic oxide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as aconitane-type diterpenoid alkaloids. These are alkaloid diterpenoids with a structure based on the hexacyclic aconitane skeleton. These compounds have no oxygen functionality at the C7 atom.

External Descriptors

CHEBI:5061 : diterpenoid

Previous Back Next