Structure Information
Structure

Compound Identification

SMILES

CCC(CC)(C1=CC(C)=C(CCC(O)=O)C=C1)C1=CC(C)=C(C=C1)C#CC1(O)CCCC1

InChIKey

InChIKey=NWDAVRAGSOHLDM-UHFFFAOYSA-N

Formula

C29H36O3

Mass

432.604

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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

Sesquiterpenoids

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Bisabolane sesquiterpenoid - Sesquiterpenoid - Diphenylmethane - 3-phenylpropanoic-acid - Phenylpropane - Toluene - Benzenoid - Ynone - Cyclopentanol - Monocyclic benzene moiety - Tertiary alcohol - Cyclic alcohol - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Alcohol - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as sesquiterpenoids. These are terpenes with three consecutive isoprene units.

External Descriptors

Not available

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