Structure Information
Structure

Compound Identification

SMILES

COC(=O)CC1C(=O)CCC(C)C(=O)O[C@@H]2[C@@H]3[C@@H](OC(C)=O)[C@@]45O[C@@]3(C)COC(=O)C3=C(C=CN=C3)C(C)C(C)(O)C(=O)O[C@@H]([C@H](OC(C)=O)[C@H](OC(C)=O)[C@@]4(COC1=O)[C@@H]2OC(C)=O)[C@]5(C)O

InChIKey

InChIKey=GSBZVVMZYQMZBG-XMOOUNKUSA-N

Formula

C45H55NO22

Mass

961.92

Export to:

JSON SDF CSV

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 - Agarofuran - Sesquiterpenoid - Macrolide - Pyridine carboxylic acid - Oxepane - Pyridine - 1,3-dicarbonyl compound - Monosaccharide - Cyclic alcohol - Tertiary alcohol - Tetrahydrofuran - Heteroaromatic compound - Methyl ester - Ketone - Lactone - Carboxylic acid ester - Cyclic ketone - Carboxylic acid derivative - Dialkyl ether - Ether - Oxacycle - Azacycle - Organoheterocyclic compound - Organic oxide - Alcohol - Organopnictogen compound - Hydrocarbon derivative - Carbonyl group - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - 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

CHEBI:66277 : acetate ester - pyridines - methyl ester - macrocyclic lactone - sesquiterpene alkaloid - terpene lactone

Previous Back Next