Structure Information
Structure

Compound Identification

SMILES

COC1=C(C)C=C2[C@H]3C[C@H](O)[C@H](C(C)(C)O)[C@@]3(C)CC[C@H](C)C2=C1

InChIKey

InChIKey=FZENUYZVBHVPLY-JPCXWIOISA-N

Formula

C21H32O3

Mass

332.484

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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

Sphaeroane diterpenoids

Alternative Parents

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

Sphaeroane diterpenoid - Anisole - Alkyl aryl ether - Benzenoid - Tertiary alcohol - Cyclic alcohol - Secondary alcohol - Ether - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Alcohol - Aromatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as sphaeroane diterpenoids. These are diterpenoids with a structure based on the 3a,6,9-trimethyl-3-(propan-2-yl)-tetradecahydrocyclohexa[e]azulene skeleton or formally 2,7-cyclodolabellane.

External Descriptors

LIPIDMAPS (LMPR0104270001) : Sphaeroane diterpenoids

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