Structure Information
Structure

Compound Identification

SMILES

CC(C)(C)OC(=O)CC[C@@H](CO)NC(=O)[C@@]12C[C@H]3OC(=O)[C@@H]1N(CC1=CC=CC(C=C4CCC5O[C@]5(C)CC[C@@H]5[C@@H]4CC5(C)C)=C1)O[C@@H]2[C@H]1OC2(CC4=CC=CC=C4C2)O[C@@H]31

InChIKey

InChIKey=RLQPZYABXHMBAH-ITCGBPOWSA-N

Formula

C49H62N2O10

Mass

839.039

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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

Not available

Direct Parent

Terpene lactones

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Terpene lactone - Sesquiterpenoid - Caryophyllane sesquiterpenoid - Alpha-amino acid ester - Gamma amino acid or derivatives - Alpha-amino acid or derivatives - Indane - Delta valerolactone - Fatty acid ester - Ketal - Delta_valerolactone - Dicarboxylic acid or derivatives - Oxane - Fatty acyl - Benzenoid - Monocyclic benzene moiety - Meta-dioxolane - Isoxazolidine - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Lactone - Carboxylic acid derivative - Acetal - Dialkyl ether - Oxacycle - Oxirane - Ether - Azacycle - N-organohydroxylamine - Organoheterocyclic compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Primary alcohol - Organopnictogen compound - Organic oxide - Carbonyl group - Organic nitrogen compound - Alcohol - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as terpene lactones. These are prenol lipids containing a lactone ring.

External Descriptors

Not available

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