Structure Information
Structure

Compound Identification

SMILES

COC[C@@]12CCC(OC)C34[C@@H]5CC6(O)C(OC(=O)C7=CC=CC=C7)[C@@H]5[C@@](C[C@@H]6OC)(OC(C)=O)[C@@H](C(OC)[C@H]13)[C@@H]4N(C2)C=O

InChIKey

InChIKey=GBMABZYFIUYWPG-PKVFBNEKSA-N

Formula

C33H43NO10

Mass

613.704

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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 - Benzoate ester - Quinolidine - Benzoic acid or derivatives - Alkaloid or derivatives - Benzoyl - Azepane - Monocyclic benzene moiety - Benzenoid - Piperidine - Dicarboxylic acid or derivatives - Cyclic alcohol - Tertiary carboxylic acid amide - Tertiary alcohol - Carboxylic acid ester - Carboxamide group - Ether - Carboxylic acid derivative - Dialkyl ether - Organoheterocyclic compound - Azacycle - Alcohol - Organonitrogen compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - 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

Not available

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