Structure Information
Structure

Compound Identification

SMILES

C[C@@]1(C[C@@]2(O)[C@@H]3CCC(=C)[C@@H]4CCC(=C)[C@@H]4[C@H]3OC2=O)CCC(=O)[C@]2(C)CCC3[C@H](OC(=O)C3=C)[C@@H]12

InChIKey

InChIKey=DLIISCBVNDNVDV-HUAZKTASSA-N

Formula

C30H38O6

Mass

494.628

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Prenol lipids

Subclass

Terpene lactones

Intermediate Tree Nodes

Sesquiterpene lactones

Direct Parent

Guaianolides and derivatives

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Eudesmanolide - Guaianolide-skeleton - Eremophilanolide or secoeremophilanolide - Guaiane sesquiterpenoid - Sesquiterpenoid - Naphthofuran - Dicarboxylic acid or derivatives - Gamma butyrolactone - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Oxolane - Tertiary alcohol - Lactone - Ketone - Carboxylic acid ester - Organoheterocyclic compound - Oxacycle - Carboxylic acid derivative - Alcohol - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Carbonyl group - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as guaianolides and derivatives. These are diterpene lactones with a structure characterized by the presence of a gamma-lactone fused to a guaiane, forming 3,6,9-trimethyl-azuleno[4,5-b]furan-2-one or a derivative.

External Descriptors

Not available

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