Structure Information
Structure

Compound Identification

SMILES

C[C@@]12CC[C@@H]3[C@H](CC3(C)C)C(CCC1O2)=CC1=CC=CC=C1C(=O)O[C@@H]1CC(=C[C@H]2OC3(CC4=CC=CC=C4C3)O[C@@H]12)C(=O)NCCC(=O)NCCO

InChIKey

InChIKey=KWSJOQKPVOIUTQ-WULVCTAUSA-N

Formula

C43H52N2O8

Mass

724.895

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Prenol lipids

Subclass

Sesquiterpenoids

Intermediate Tree Nodes

Not available

Direct Parent

Sesquiterpenoids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Sesquiterpenoid - Caryophyllane sesquiterpenoid - Beta amino acid or derivatives - Benzoate ester - Benzoic acid or derivatives - Indane - N-acylethanolamine - Benzoyl - Ketal - Benzenoid - Monocyclic benzene moiety - Meta-dioxolane - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Alkanolamine - Monocarboxylic acid or derivatives - Acetal - Ether - Oxirane - Dialkyl ether - Organoheterocyclic compound - Carboxylic acid derivative - Oxacycle - Organic oxide - Carbonyl group - Organic oxygen compound - Organonitrogen compound - Organic nitrogen compound - Organooxygen compound - Primary alcohol - Organopnictogen compound - Alcohol - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as sesquiterpenoids. These are terpenes with three consecutive isoprene units.

External Descriptors

Not available

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