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Chemical structure of Monensin sodium salt

GC16995

Monensin sodium salt

Also known as sodium 4-[2-[5-ethyl-5-[5-[6-hydroxy-6-(hydroxymethyl)-3,5-dimethyloxan-2-yl]-3-methyloxolan-2-yl]oxolan-2-yl]-7-hydroxy-2,8-dimethyl-1,10-dioxaspiro[4.5]decan-9-yl]-3-methoxy-2-methylpentanoate

Monensin sodium salt is an antibiotic secreted by the bacteria Streptomyces cinnamonensis

ChemicalCAS22373-78-0MW692.85FormulaC36H61NaO11
CAS number
22373-78-0
Molecular weight
692.85
Formula
C36H61NaO11
Solubility
≥ 69·3mg/mL in EtOH with ultrasonic, ＜6·93mg/mL in DMSO
InChIKey
XOIQMTLWECTKJL-UHFFFAOYSA-M
Catalogue number
GC16995
Brand
GLPBIO
Computed properties PubChem CID 16760571 · TPSA 156 Ų · H-bond donors 3 · H-bond acceptors 11
TPSA
156 Ų
H-bond donors
3
H-bond acceptors
11
Rotatable bonds
10
Heavy atoms
48

SMILES CCC1(CCC(O1)C2(CCC3(O2)CC(C(C(O3)C(C)C(C(C)C(=O)[O-])OC)C)O)C)C4C(CC(O4)C5C(CC(C(O5)(CO)O)C)C)C.[Na+]

Computed descriptors from PubChem (CID 16760571), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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