General Information of Drug (ID: DMEFK3A)

Drug Name
Monensin sodium
Synonyms
AKOS025147337; AM84797; C36H61NaO11; CAS-22373-78-0; CCG-220748; CHEMBL1908308; CS-0007881; DSSTox_CID_25573; DSSTox_GSID_45573; DSSTox_RID_80970; DTXSID2045573; HMS2097E18; HMS3714E18; HY-N0150; MLS002153986; Monensin A sodium salt; Monensin sodium salt; NCGC00017089-01; NSC343257; SMR001233320; Sodium monensin; Tox21_110771; Tox21_113191; XOIQMTLWECTKJL-FBZUZRIGSA-M; s2324
Indication
Disease Entry ICD 11 Status REF
Middle East Respiratory Syndrome (MERS) 1D64 Investigative [1]
Drug Type
Small molecular drug
Structure
3D MOL 2D MOL
Chemical Identifiers
Formula
C36H61NaO11
Canonical 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+]
InChI
1S/C36H62O11.Na/c1-10-34(31-20(3)16-26(43-31)28-19(2)15-21(4)36(41,18-37)46-28)12-11-27(44-34)33(8)13-14-35(47-33)17-25(38)22(5)30(45-35)23(6)29(42-9)24(7)32(39)40;/h19-31,37-38,41H,10-18H2,1-9H3,(H,39,40);/q;+1/p-1/t19-,20-,21+,22+,23-,24-,25-,26+,27+,28-,29+,30-,31+,33-,34-,35+,36-;/m0./s1
InChIKey
XOIQMTLWECTKJL-FBZUZRIGSA-M
Cross-matching ID
PubChem CID
23667299
CAS Number
22373-78-0
TTD ID
D0RG9A

References

1 High-Throughput Screening and Identification of Potent Broad-Spectrum Inhibitors of Coronaviruses. J Virol. 2019 May 29;93(12). pii: e00023-19.