Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1CC(=O)CC(C)CCC=C(C)CCC(C(C)C)C(=O)C1S(=O)C1=CC=CC=C1

InChIKey

InChIKey=YLNQLFZDDRUOLA-UHFFFAOYSA-N

Formula

C27H38O5S

Mass

474.66

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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

Cembrane diterpenoids

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Cembrane diterpenoid - Phenyl sulfoxide - Monocyclic benzene moiety - Benzenoid - Methyl ester - Carboxylic acid ester - Ketone - Sulfoxide - Cyclic ketone - Monocarboxylic acid or derivatives - Sulfinyl compound - Carboxylic acid derivative - Organosulfur compound - Organooxygen compound - Organic oxygen compound - Organic oxide - Carbonyl group - Hydrocarbon derivative - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as cembrane diterpenoids. These are diterpenoids with a structure based a cembrane skeleton, which is characterized by the presence of an isopropyl group at C-1 and by three symmetrically disposed methyl groups a the t C-4, -8 and -12 positions.

External Descriptors

Not available

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