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Chemical structure of Doramectin monosaccharide

GC43563

Doramectin monosaccharide

Also known as (1'R,2R,3S,4'S,6S,8'R,10'Z,12'S,13'S,14'Z,20'R,21'R,24'S)-2-cyclohexyl-21',24'-dihydroxy-12'-[(2R,4S,5S,6S)-5-hydroxy-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

Doramectin monosaccharide is an acid degradation product of doramectin, a disaccharide-containing anthelmintic that potentiates glutamate- and GABA-gated chloride channel opening in nematodes

ChemicalCAS165108-44-1MW755FormulaC43H62O11
CAS number
165108-44-1
Molecular weight
755
Formula
C43H62O11
Solubility
Soluble in DMSO
InChIKey
HFDCQUOZPUMCSE-CPKBAYHQSA-N
Catalogue number
GC43563
Brand
GLPBIO
Computed properties PubChem CID 137699647 · XLogP 4.1 · TPSA 142 Ų · H-bond donors 3
XLogP
4.1
TPSA
142 Ų
H-bond donors
3
H-bond acceptors
11
Rotatable bonds
4
Heavy atoms
54

SMILES C[C@H]1/C=C\C=C2CO[C@H]3[C@@]2([C@@H](C=C([C@H]3O)C)C(=O)O[C@H]4C[C@@H](C/C=C(\[C@H]1O[C@H]5C[C@@H]([C@H]([C@@H](O5)C)O)OC)/C)O[C@]6(C4)C=C[C@@H]([C@H](O6)C7CCCCC7)C)O

Computed descriptors from PubChem (CID 137699647), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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