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TAKAKIN-8-O-BETA-GLUCURONIDE-2''-SODIUM-SULPHATE
SpectraBase Compound ID 9RpKpRdDFwC
InChI InChI=1S/C22H20O15S.Na/c1-33-9-4-2-8(3-5-9)13-7-11(24)14-10(23)6-12(25)17(18(14)34-13)35-22-20(37-38(30,31)32)16(27)15(26)19(36-22)21(28)29;/h2-7,15-16,19-20,22-23,25-27H,1H3,(H,28,29)(H,30,31,32);/q;+1/p-1/t15-,16-,19-,20+,22+;/m1./s1
InChIKey YNIQMBIKXJQIQA-HRNZSKTESA-M
Mol Weight 578.43 g/mol
Molecular Formula C22H19NaO15S
Exact Mass 578.034235 g/mol
Parent InChIKey XRHYTEAKTRSKAB-QEXGSCJRSA-M
Enantiomer InChIKey YNIQMBIKXJQIQA-FNWLFQBVSA-M
Unknown Identification

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