Structure Information
Structure

Compound Identification

SMILES

CCCC(=O)O[C@@H]1O[C@H](OC(C)=O)[C@]23[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H](C)[C@](C)(CCC(=C)C=C)[C@H]2C[C@H](OC(=O)C(C)CC)C=C13

InChIKey

InChIKey=IQJYOZIDRHQZPD-QOWPTCOOSA-N

Formula

C35H50O11

Mass

646.774

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

Colensane and clerodane diterpenoids

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Clerodane diterpenoid - Pentacarboxylic acid or derivatives - Naphthofuran - Fatty acid ester - Fatty acyl - Tetrahydrofuran - Carboxylic acid ester - Organoheterocyclic compound - Oxacycle - Carboxylic acid derivative - Acetal - Hydrocarbon derivative - Organooxygen compound - Organic oxide - Organic oxygen compound - Carbonyl group - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as colensane and clerodane diterpenoids. These are diterpenoids with a structure based on the clerodane or the colensane skeleton. Clerodanes arise from labdanes by two methyl migrations.

External Descriptors

Not available

Previous Back Next