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Indomethacin Acyl-Beta-D-glucuronide

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For Research Use Only | Not For Clinical Use
CATAPS75523114
CAS75523-11-4
Structure
IUPAC Name(2S,3S,4S,5R,6S)-6-[2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]acetyl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
Molecular Weight533.91
Molecular FormulaC25H24ClNO10
Canonical SMILESCOc1ccc2c(c1)c(CC(=O)O[C@@H]3O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)C(=O)O)c(C)n2C(=O)c4ccc(Cl)cc4
InChIInChI=1S/C25H24ClNO10/c1-11-15(10-18(28)36-25-21(31)19(29)20(30)22(37-25)24(33)34)16-9-14(35-2)7-8-17(16)27(11)23(32)12-3-5-13(26)6-4-12/h3-9,19-22,25,29-31H,10H2,1-2H3,(H,33,34)/t19-,20-,21+,22-,25+/m0/s1
Accurate Mass533.1089
FormatNeat
SubcategoryEnzyme activators
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