Structure Information
Structure

Compound Identification

SMILES

C[C@]1(CO)C=CC[C@@]2(C)[C@H]1CC[C@]1(C=O)[C@@H]2CCC2=COC=C12

InChIKey

InChIKey=IGELPBHXNITJDE-MFKWGIFDSA-N

Formula

C20H26O3

Mass

314.425

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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

Isocopalane and spongiane diterpenoids

Alternative Parents

Heteroaromatic compounds Furans Oxacyclic compounds Primary alcohols Organic oxides Hydrocarbon derivatives Aldehydes

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Spongiane diterpenoid - Heteroaromatic compound - Furan - Oxacycle - Organoheterocyclic compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Primary alcohol - Organooxygen compound - Carbonyl group - Aldehyde - Alcohol - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as isocopalane and spongiane diterpenoids. These are diterpenoids with a structure based on the isocopalane (Tetradecahydro-1,1,4a,7,8,8a-hexamethylphenanthrene) or the 15,16-epoxyisocopalane skeleton.

External Descriptors

Not available

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