Structure Information
Structure

Compound Identification

SMILES

CC(C)CC(=O)OC1CC2(COC(C)=O)C(OC3C(O[Si](C)(C)C)C(OC(C)=O)C2(C)C32CO2)C=C1C

InChIKey

InChIKey=FQEACWYAOHYFPW-UHFFFAOYSA-N

Formula

C27H42O9Si

Mass

538.709

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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

Trichothecenes

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Trichothecene skeleton - Tricarboxylic acid or derivatives - Fatty acid ester - Oxepane - Oxane - Fatty acyl - Trialkylheterosilane - Carboxylic acid ester - Silyl ether - Carboxylic acid derivative - Dialkyl ether - Oxirane - Ether - Organoheterosilane - Oxacycle - Organic metalloid salt - Organoheterocyclic compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Organosilicon compound - Carbonyl group - Organic salt - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as trichothecenes. These are sesquiterpene mycotoxins structurally characterized by the presence of an epoxide ring and a benzopyran derivative with a variant number of hydroxyl, acetyl, or other substituents. The most important structural features causing the biological activities of trichothecenes are the 12,13-epoxy ring, the presence of hydroxyl or acetyl groups at appropriate positions on the trichothecene nucleus and the structure and position of the side-chain.

External Descriptors

Not available

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