Structure Information
Structure

Compound Identification

SMILES

CC[C@@H](C)C(=O)O[C@@H]1[C@H](C[C@@]23[C@@H]4C[C@H]5C(=C)C[C@]44CC(=O)[C@H]2[C@]1(C)CN(C)[C@H]3[C@H]4C5=O)OC(C)=O

InChIKey

InChIKey=CZQOWDLZQUUTQR-IVDUFZQNSA-N

Formula

C28H37NO6

Mass

483.605

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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

Villanovane, atisane, trachylobane or helvifulvane diterpenoids - Atisane diterpenoids

Direct Parent

Hetidine-type diterpenoid alkaloids

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Hetidine-type diterpenoid alkaloid - Alkaloid or derivatives - Fatty acid ester - Fatty acyl - Piperidine - Dicarboxylic acid or derivatives - Tertiary aliphatic amine - Tertiary amine - Ketone - Carboxylic acid ester - Amino acid or derivatives - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Amine - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as hetidine-type diterpenoid alkaloids. These are alkaloid diterpenoids with a structure based on the hetidine skeleton, which is a hexacyclic compound with an additional C-20-C-14 bond in the atisine-type.

External Descriptors

Not available

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