Structure Information
Structure

Compound Identification

SMILES

[H][C@@]12C[C@@]3([H])C(=C)C[C@@]11CC(=O)[C@@]4([H])[C@@]22C[C@@]([H])(OC(C)=O)[C@@]([H])(OC(=O)C5=CC=CC=C5)[C@]4(C)CN(C)[C@]2([H])[C@@]1([H])C3=O

InChIKey

InChIKey=PZNXWOJHEGLWBY-QSJYZHIZSA-N

Formula

C30H33NO6

Mass

503.595

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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

Aromatic heteropolycyclic compounds

Substituents

Hetidine-type diterpenoid alkaloid - Benzoate ester - Benzoic acid or derivatives - Alkaloid or derivatives - Benzoyl - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Benzenoid - Piperidine - Amino acid or derivatives - Carboxylic acid ester - Tertiary aliphatic amine - Tertiary amine - Ketone - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Amine - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Aromatic 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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