Structure Information
Structure

Compound Identification

SMILES

CC1=C(COCC2=CC=CC=C2)[C@@]2(C)CC[C@@H]3C(C)(C)[C@@H](CC[C@@]3(C)[C@@H]2C[C@@H]1O)OCC1=CC=CC=C1

InChIKey

InChIKey=NUVRXRXHOQXLFA-CXDHSSNGSA-N

Formula

C34H46O3

Mass

502.739

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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

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

Isocopalane diterpenoid - 12-hydroxysteroid - Hydroxysteroid - 12-alpha-hydroxysteroid - Steroid - Phenanthrene - Hydrophenanthrene - Benzylether - Benzenoid - Monocyclic benzene moiety - Secondary alcohol - Ether - Dialkyl ether - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Alcohol - Aromatic homopolycyclic 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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