Compound Identification
SMILES
CC[C@H](C)[C@H]1O[C@@]2(C[C@@H]3C[C@@H](C\C=C(C)\[C@@H](O)[C@@H](C)\C=C\C=C4/COC5[C@H](O[Si](C)(C)C(C)(C)C)C(C)=C[C@@H](C(=O)O3)[C@]45O[Si](C)(C)C)O2)C[C@H](O[Si](C)(C)C(C)(C)C)[C@@H]1C
InChIKey
InChIKey=XQNOAZLQICKQED-QVPCQDFHSA-N
Formula
C49H86O9Si3
Mass
903.473
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Macrolides and analogues
- Subclass Milbemycins
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Class
Macrolides and analogues
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Macrolides and analogues
Subclass
Milbemycins
Intermediate Tree Nodes
Not available
Direct Parent
Milbemycins
Alternative Parents
Ketals Oxanes Trialkylheterosilanes Oxolanes Silyl ethers Secondary alcohols Lactones Carboxylic acid esters Oxacyclic compounds Organic metalloid salts Monocarboxylic acids and derivatives Dialkyl ethers Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Milbemycin - Ketal - Oxane - Trialkylheterosilane - Oxolane - Carboxylic acid ester - Lactone - Secondary alcohol - Silyl ether - Acetal - Carboxylic acid derivative - Dialkyl ether - Ether - Organoheterosilane - Monocarboxylic acid or derivatives - Oxacycle - Organic metalloid salt - Organoheterocyclic compound - Organic oxide - Organic oxygen compound - Organic metalloid moeity - Organooxygen compound - Hydrocarbon derivative - Carbonyl group - Organosilicon 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