Structure Information
Structure

Compound Identification

SMILES

CC(C)C1=CC2=C(C)C=C(C(=O)OC3=C(C)C(C)=C(O)C=C3)C2=C(C)C=C1

InChIKey

InChIKey=OBCKGALULOAHJC-UHFFFAOYSA-N

Formula

C24H26O3

Mass

362.469

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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

Aromatic homopolycyclic compounds

Substituents

Guaiane sesquiterpenoid - Azulene - Phenol ester - O-xylene - Xylene - Phenoxy compound - O-cresol - M-cresol - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Monocyclic benzene moiety - Benzenoid - Carboxylic acid ester - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Aromatic 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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