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Structure Information
Structure

Compound Identification

SMILES

CC1=C2[C@H]3OC(=O)[C@@H](CN4CCC(CC5=CC=CC=C5)CC4)[C@@H]3CC[C@@]2(C)C=CC1=O

InChIKey

InChIKey=OEOMMWMJRTXXIW-CUBKFYFCSA-N

Formula

C27H33NO3

Mass

419.565

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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

Eudesmanolides, secoeudesmanolides, and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Eudesmanolide - Sesquiterpenoid - Naphthofuran - 4-benzylpiperidine - Benzylpiperidine - Aralkylamine - Monocyclic benzene moiety - Gamma butyrolactone - Piperidine - Benzenoid - Oxolane - Cyclic ketone - Carboxylic acid ester - Tertiary aliphatic amine - Tertiary amine - Amino acid or derivatives - Ketone - Lactone - Azacycle - Organoheterocyclic compound - Oxacycle - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organic oxide - Organic nitrogen compound - Hydrocarbon derivative - Amine - Organooxygen compound - Carbonyl group - Organic oxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as eudesmanolides, secoeudesmanolides, and derivatives. These are terpenoids with a structure based on the eudesmanolide (a 3,5a,9-trimethyl-naphtho[1,2-b]furan-2-one derivative) or secoeudesmanolide (a 3,6-dimethyl-5-(pentan-2-yl)-1-benzofuran-2-one derivative) skeleton.

External Descriptors

Not available

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