| SpectraBase Spectrum ID |
2QbnvHbtClD |
| Name |
Sucrose-6-phosphate, 9TMS |
| Comments |
Derivatization type: 9 TMS (mass: 1070.438); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib001077; Note: The molecular formula of the structure shown is C12H23O14P - which differs from the formula reported for the mass spectrum (C39H95O14PSi9) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C39H95O14PSi9 |
| InChI |
InChI=1S/C39H95O14PSi9/c1-55(2,3)42-29-31-33(47-57(7,8)9)35(49-59(13,14)15)36(50-60(16,17)18)38(44-31)46-39(30-43-56(4,5)6)37(51-61(19,20)21)34(48-58(10,11)12)32(45-39)28-41-54(40,52-62(22,23)24)53-63(25,26)27/h31-38H,28-30H2,1-27H3/t31-,32-,33-,34-,35+,36-,37+,38-,39+/m1/s1 |
| InChIKey |
OYKJUMQXRZYLMJ-PMDGWJKGSA-N |
| Molecular Weight |
1071.914 g/mol |
| SMILES |
C([C@@]1([C@]([C@@]([C@]([C@](O1)(O[C@@]1(CO[Si](C)(C)C)[C@]([C@@]([C@@](COP(O[Si](C)(C)C)(O[Si](C)(C)C)=O)(O1)[H])(O[Si](C)(C)C)[H])(O[Si](C)(C)C)[H])[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 |
splash10-01ba-0953000000-ad775a2a79e26f18bf1c |
| Source of Spectrum |
FM-2019-1077-0 |
| Synonyms |
Sucrose 6-phosphate, 9TMS
Sugar 1-phosphate, 9TMS
Sucrose 6F-phosphate, 9TMS
Sucrose 6(F)-phosphate, 9TMS
SUCROSE-6-PHOSHPATE, 9TMS
CHEBI:16308, 9TMS
[(2R,3S,4S,5S)-3,4-dihydroxy-5-(hydroxymethyl)-5-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxolan-2-yl]methyl dihydrogen phosphate, 9TMS
((2R,3R,4S,5S)-3,4-bis((trimethylsilyl)oxy)-5-(((trimethylsilyl)oxy)methyl)-5-(((2R,3R,4S,5R,6R)-3,4,5-tris((trimethylsilyl)oxy)-6-(((trimethylsilyl)oxy)methyl)tetrahydro-2H-pyran-2-yl)oxy)tetrahydrofuran-2-yl)methyl bis(trimethylsilyl) phosphate |
| Wiley ID |
1818735 |
