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Glucose-1-phosphate, 6TMS
SpectraBase Compound ID K7NIJtEvWkV
InChI InChI=1S/C24H61O9PSi6/c1-35(2,3)26-19-20-21(29-36(4,5)6)22(30-37(7,8)9)23(31-38(10,11)12)24(27-20)28-34(25,32-39(13,14)15)33-40(16,17)18/h20-24H,19H2,1-18H3/t20-,21-,22+,23-,24-/m1/s1
InChIKey ADQOIWLAUVHGNY-GNADVCDUSA-N
Mol Weight 693.2 g/mol
Molecular Formula C24H61O9PSi6
Exact Mass 692.26688 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8YFLVahorA7
Name Glucose-1-phosphate, 6TMS
Comments Derivatization type: 6 TMS (mass: 692.267); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib001094; Note: The molecular formula of the structure shown is C6H13O9P - which differs from the formula reported for the mass spectrum (C24H61O9PSi6)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H61O9PSi6
InChI InChI=1S/C24H61O9PSi6/c1-35(2,3)26-19-20-21(29-36(4,5)6)22(30-37(7,8)9)23(31-38(10,11)12)24(27-20)28-34(25,32-39(13,14)15)33-40(16,17)18/h20-24H,19H2,1-18H3/t20-,21-,22+,23-,24-/m1/s1
InChIKey ADQOIWLAUVHGNY-GNADVCDUSA-N
Molecular Weight 693.227 g/mol
SMILES C([C@@]1([C@]([C@@]([C@]([C@](O1)(OP(O[Si](C)(C)C)(O[Si](C)(C)C)=O)[H])(O[Si](C)(C)C)[H])(O[Si](C)(C)C)[H])(O[Si](C)(C)C)[H])[H])O[Si](C)(C)C
SPLASH splash10-014i-0890000000-cb800147fb5e99a510e7
Source of Spectrum FM-2019-1094-0
Synonyms cori ester, 6TMS Glucos P, 6TMS Glucose-1P, 6TMS Glucose-1-phosphate, 6TMS Glucose monophosphate, 6TMS alpha-D-glucose-1-phosphate, 6TMS [(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] dihydrogen phosphate, 6TMS bis(trimethylsilyl) ((2R,3R,4S,5R,6R)-3,4,5-tris((trimethylsilyl)oxy)-6-(((trimethylsilyl)oxy)methyl)tetrahydro-2H-pyran-2-yl) phosphate
Wiley ID 1818752