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SMILES: COc1c2ccccc2c(c2c1ccc(c2)S(=O)(=O)[O-])OC.O.[Na+] Canonical SMILES: COc1c2cc(ccc2c(c2c1cccc2)OC)S(=O)(=O)[O-].O.[Na+] InChI: InChI=1S/C16H14O5S.Na.H2O/c1-20-15-11-5-3-4-6-12(11)16(21-2)14-9-10(22(17,18)19)7-8-13(14)15;;/h3-9H,1-2H3,(H,17,18,19);;1H2/q;+1;/p-1 InChIKey: NGXAGKVEVBJNRP-UHFFFAOYSA-M
CBID:146705 http://www.chembase.cn/molecule-146705.html