Structure Information
Structure

Compound Identification

SMILES

COC(=O)[C@@H]1CCC[C@@]2(C)[C@@H]1[C@@H](C[C@H]1C[C@@H]3CC21CC[C@@]3(C)O)OC(=O)C1=CC=CC=C1

InChIKey

InChIKey=IFYYILLQBMRJSK-AQGGARRLSA-N

Formula

C27H36O5

Mass

440.58

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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

Aphidicolane and stemodane diterpenoids

Alternative Parents

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

Aphidicolane or stemodane diterpenoid - Benzoate ester - Benzoic acid or derivatives - Benzoyl - Monocyclic benzene moiety - Benzenoid - Dicarboxylic acid or derivatives - Methyl ester - Tertiary alcohol - Cyclic alcohol - Carboxylic acid ester - Carboxylic acid derivative - Carbonyl group - Organic oxygen compound - Alcohol - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Aromatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as aphidicolane and stemodane diterpenoids. These are diterpenoids with a structure based on the aphidicolane or the stemodane skeleton.

External Descriptors

Not available

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