Structure Information
Structure

Compound Identification

SMILES

CO[C@H]1C[C@]2(O)[C@@H](C=C1C)C(=O)O[C@H]1C[C@H](C\C=C(C)\C[C@@H](C)\C=C\C=C2\CO)O[C@@]2(CC[C@H](C)[C@@H](C)O2)C1

InChIKey

InChIKey=GVTIOOAINDAZRR-AEDOMJCLSA-N

Formula

C32H48O7

Mass

544.729

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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 - Ketal - Oxane - Tertiary alcohol - Carboxylic acid ester - Lactone - Acetal - Carboxylic acid derivative - Dialkyl ether - Ether - Monocarboxylic acid or derivatives - Oxacycle - Organoheterocyclic compound - Carbonyl group - Organic oxide - Hydrocarbon derivative - Alcohol - Organooxygen compound - Organic oxygen compound - Primary 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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