Structure Information
Structure

Compound Identification

SMILES

CC(C)C1=CC2C(CC[C@@]2(C)S(O)(=O)=O)[C@@](C)(O)CC1

InChIKey

InChIKey=PQQXTQLPHMIWHX-PFSRBDOWSA-N

Formula

C15H26O4S

Mass

302.43

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Prenol lipids

Subclass

Sesquiterpenoids

Intermediate Tree Nodes

Not available

Direct Parent

Guaianes

Alternative Parents

Molecular Framework

Aliphatic homopolycyclic compounds

Substituents

Guaiane sesquiterpenoid - Alkanesulfonic acid - Tertiary alcohol - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Alcohol - Aliphatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as guaianes. These are sesquiterpenoids with a structure based on the guaiane skeleton. Guaiane is a bicyclic compound consisting of a decahydroazulene moiety, substituted with two methyl groups and a 1-methylethyl group at the 1-, 4-, and 7-position, respectively.

External Descriptors

Not available

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