Structure Information
Structure

Compound Identification

SMILES

C[C@H]1CC[C@H]2C(CN3CCC(O)(CC3)C3=CC=CC=C3)C(=O)O[C@H]2[C@@]2(C)[C@H]1C(CC2=O)N1CCC(O)(CC1)C1=CC=CC=C1

InChIKey

InChIKey=PFCSZKBLPXYUPY-YLLKCVSYSA-N

Formula

C37H48N2O5

Mass

600.8

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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

Ambrosanolides and secoambrosanolides

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Ambrosanolide - Pseudoguaiane sesquiterpenoid - Sesquiterpenoid - Phenylpiperidine - Aralkylamine - Monocyclic benzene moiety - Gamma butyrolactone - Piperidine - Benzenoid - Oxolane - Tertiary alcohol - Amino acid or derivatives - Carboxylic acid ester - Ketone - Lactone - Tertiary aliphatic amine - Tertiary amine - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Oxacycle - Azacycle - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Alcohol - Amine - Organic oxide - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as ambrosanolides and secoambrosanolides. These are sesquiterpene lactones from the Ambrosia family, with a backbone derivative of azuleno[6,5-b]furan-2-one (ambrosanolides) or azuleno[4,5-b]furan-2-one (secoambrosanolides).

External Descriptors

Not available

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