Structure Information
Structure

Compound Identification

SMILES

[H]C12C(O)C(=O)\C3=C/C=C/C(C)C\C(C)=C\CC4([H])CC(CC5(CCC(C)C(CC)O5)O4)OC(=O)C([H])(C=C(C)C1O)C23O

InChIKey

InChIKey=BRHBYTLDUTWJBG-MJXBDMQGSA-N

Formula

C33H46O8

Mass

570.723

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Macrolides and analogues

Subclass

Milbemycins

Intermediate Tree Nodes

Not available

Direct Parent

Milbemycins

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Milbemycin - Diterpenoid - Diterpene lactone - Fatty alcohol ester - Ketal - Fatty acid ester - Fatty acyl - Alpha-branched alpha,beta-unsaturated-ketone - Oxane - Beta-hydroxy ketone - Acyloin - Alpha,beta-unsaturated ketone - Tertiary alcohol - Enone - Cyclic alcohol - Alpha-hydroxy ketone - Acryloyl-group - Secondary alcohol - Lactone - Ketone - Carboxylic acid ester - Oxacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Alcohol - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as milbemycins. These are a group of macrolides with a structure containing a 16-membered lactone ring fused to a 1,7-dioxaspiroundecane ring system and to either a benzofuran (or hydrogenated derivative thereof). In some cases (e.g. Milbemycin E), the tetrahydrofuranyl ring is missing. Milbemycins can be o-glycosylated at C13 to form Avermectins. Milbemycins are produced by Streptomyces species.

External Descriptors

Not available

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