Structure Information
Structure

Compound Identification

SMILES

C\C=C(\C)C(=O)O[C@@]1(C)[C@H]2[C@@H](OC1=O)\C=C(C)\CC\C=C(C)\C[C@@H]2OC(C)=O

InChIKey

InChIKey=YWZRKODHWXAKHS-QNKWTIDMSA-N

Formula

C22H30O6

Mass

390.476

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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

Germacranolides and derivatives

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Germacranolide - Germacrane sesquiterpenoid - Sesquiterpenoid - Tricarboxylic acid or derivatives - Fatty acid ester - Gamma butyrolactone - Fatty acyl - Enoate ester - Tetrahydrofuran - Alpha,beta-unsaturated carboxylic ester - Lactone - Carboxylic acid ester - Oxacycle - Carboxylic acid derivative - Organoheterocyclic compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as germacranolides and derivatives. These are sesquiterpene lactones with a structure based on the germacranolide skeleton, characterized by a gamma lactone fused to a 1,7-dimethylcyclodec-1-ene moiety.

External Descriptors

CHEBI:6380 : germacranolide
KEGG (C09491) : Germacrenes

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