| SpectraBase Spectrum ID |
9aThrjpNAEb |
| Name |
Glucuronic acid, 5TMS |
| Comments |
Derivatization type: 5 TMS (mass: 554.24); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib000531; Note: The molecular formula of the structure shown is C6H10O7 - which differs from the formula reported for the mass spectrum (C21H50O7Si5) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H50O7Si5 |
| InChI |
InChI=1S/C21H50O7Si5/c1-29(2,3)24-16-17(25-30(4,5)6)19(26-31(7,8)9)21(28-33(13,14)15)23-18(16)20(22)27-32(10,11)12/h16-19,21H,1-15H3/t16-,17-,18-,19+,21?/m0/s1 |
| InChIKey |
ZJKACRRFXMWHBG-MCXOOUIESA-N |
| Molecular Weight |
555.049 g/mol |
| SMILES |
[C@]1([C@@]([C@@](C(=O)O[Si](C)(C)C)(OC([C@@]1(O[Si](C)(C)C)[H])O[Si](C)(C)C)[H])(O[Si](C)(C)C)[H])(O[Si](C)(C)C)[H] |
| SPLASH |
splash10-000j-2920000000-153d4857da2f03edb0d7 |
| Source of Spectrum |
FM-2019-531-0 |
| Synonyms |
Glucuronate, 5TMS
D-glucuronate, 5TMS
D-Glucopyranuronic acid, 5TMS
Maybridge1_004154, 5TMS
STOCK1N-69677, 5TMS
(2S,3S,4S,5R)-3,4,5,6-tetrahydroxyoxane-2-carboxylic acid, 5TMS
Trimethylsilyl (2S,3R,4S,5R)-3,4,5,6-tetrakis((trimethylsilyl)oxy)tetrahydro-2H-pyran-2-carboxylate |
| Wiley ID |
1818215 |
