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Pertrimethylsilylated probenecid glucuronide
SpectraBase Compound ID 402nu5a1syf
InChI InChI=1S/C31H59NO10SSi4/c1-15-21-32(22-16-2)43(35,36)24-19-17-23(18-20-24)29(33)38-31-28(41-46(9,10)11)26(40-45(6,7)8)25(39-44(3,4)5)27(37-31)30(34)42-47(12,13)14/h17-20,25-28,31H,15-16,21-22H2,1-14H3
InChIKey DASWAHSKMHJMRQ-UHFFFAOYSA-N
Mol Weight 750.2 g/mol
Molecular Formula C31H59NO10SSi4
Exact Mass 749.293674 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FRsilnOiswK
Name Pertrimethylsilylated probenecid glucuronide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H59NO10SSi4
InChI InChI=1S/C31H59NO10SSi4/c1-15-21-32(22-16-2)43(35,36)24-19-17-23(18-20-24)29(33)38-31-28(41-46(9,10)11)26(40-45(6,7)8)25(39-44(3,4)5)27(37-31)30(34)42-47(12,13)14/h17-20,25-28,31H,15-16,21-22H2,1-14H3
InChIKey DASWAHSKMHJMRQ-UHFFFAOYSA-N
Molecular Weight 750.210 g/mol
SMILES C1(C(C(O[Si](C)(C)C)C(OC1C(O[Si](C)(C)C)=O)OC(c1ccc(S(N(CCC)CCC)(=O)=O)cc1)=O)O[Si](C)(C)C)O[Si](C)(C)C
SPLASH splash10-014i-0090000000-8b10815d8ada24e6ca63
Source of Spectrum KO-17-99-14
Synonyms Trimethylsilyl 1-O-{4-[(dipropylamino)sulfonyl]benzoyl}-2,3,4-tris-O-(trimethylsilyl)hexopyranuronate [2'',3'',4'',6''-tetrakis(trimethylsilyl)glucopyranos-1''-O-acyl]4-[(dipropylamino)sulfonyl]benzoate
Wiley ID 1416302