Doramectin

Chemical data

Formula

C50H74O14

Molecular weight

899.1 g/mol

IUPAC name

(1'R,2R,3S,4'S,6S,8'R,10'E,13'S,14'E,16'E,20'R,21'R,24'S)-2-cyclohexyl-21',24'-dihydroxy-12'-[(2R,4S,6S)-5-[(2S,4S,5S,6S)-5-hydroxy-4-methoxy-6-methyloxan-2-yl]oxy-4-methoxy-6-methyloxan-2-yl]oxy-3,11',13',22'-tetramethylspiro[2,3-dihydropyran-6,6'-3,7,19-trioxatetracyclo[15.6.1.14,8.020,24]pentacosa-10,14,16,22-tetraene]-2'-one

SMILES

C[C@H]1C=C[C@]2(C[C@@H]3C[C@H](O2)C/C=C(/C([C@H](/C=C/C=C/4\CO[C@H]5[C@@]4([C@@H](C=C([C@H]5O)C)C(=O)O3)O)C)O[C@H]6C[C@@H](C([C@@H](O6)C)O[C@H]7C[C@@H]([C@H]([C@@H](O7)C)O)OC)OC)\C)O[C@@H]1C8CCCCC8

InChIKey

QLFZZSKTJWDQOS-NJPOTTGESA-N

XLogP

4.5

Polar surface area

170 Ų

H-bond donors

3

H-bond acceptors

14

Formal charge

0

via PubChem

• Ivermectin, a potential anticancer drug derived from an antiparasitic drug.Pharmacological research · 2021
• Doramectin attenuates inflammation, obesity and insulin resistance in food-borne obese mice.Biochemical and biophysical research communications · 2024
• Doramectin--a novel avermectin.Veterinary parasitology · 1993
• Doramectin Induces Apoptosis in B16 Melanoma Cells.Anti-cancer agents in medicinal chemistry · 2025
• Repurposing of Doramectin as a New Anti-Zika Virus Agent.Viruses · 2023

via PubMed

Wikidata facts

Subclass of

macrolides

Mass

898.507857

via Wikidata · CC0