Structure Information
Structure

Compound Identification

SMILES

CCC(C)C(=O)OC1CC23C4C5CC67CC(=C)C(C(O)C6(O)C2N5CC4(C)C1OC(C)=O)C(O)C37O

InChIKey

InChIKey=SQVLUNIFVQDZEK-UHFFFAOYSA-N

Formula

C27H37NO8

Mass

503.592

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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

Direct Parent

Atisane diterpenoids

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Atisane diterpenoid - Azaspirodecane - Quinolizidine - Indolizidine - Isoindoline - Isoindole or derivatives - Alkaloid or derivatives - Indole or derivatives - Azepane - Fatty acid ester - Fatty acyl - Piperidine - Dicarboxylic acid or derivatives - N-alkylpyrrolidine - Pyrrolidine - Cyclic alcohol - Tertiary alcohol - 1,2-aminoalcohol - Carboxylic acid ester - Amino acid or derivatives - Secondary alcohol - Tertiary amine - Tertiary aliphatic amine - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Polyol - Alcohol - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Amine - Organooxygen compound - Organonitrogen compound - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as atisane diterpenoids. These are diterpenoids with a structure based on the atisane skeleton, which is a tetracyclic compound containing the [2,2,2]bicyc1ic ring system with the C15-C16 bridge attached at C12.

External Descriptors

Not available

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