| Derivative Name / Structure | SMILES | Kovats RI Value | Column Type | Reference |
|---|
| 4-Methylgallic acid 3-glucuronide,1TMS,isomer #1 | COC1=C(O[C@@H]2O[C@H](C(=O)O)C(O)[C@H](O)C2O)C=C(C(=O)O)C=C1O[Si](C)(C)C | 3054.7 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,1TMS,isomer #2 | COC1=C(O)C=C(C(=O)O[Si](C)(C)C)C=C1O[C@@H]1O[C@H](C(=O)O)C(O)[C@H](O)C1O | 3042.4 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,1TMS,isomer #3 | COC1=C(O)C=C(C(=O)O)C=C1O[C@@H]1O[C@H](C(=O)O[Si](C)(C)C)C(O)[C@H](O)C1O | 3024.4 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,1TMS,isomer #4 | COC1=C(O)C=C(C(=O)O)C=C1O[C@@H]1O[C@H](C(=O)O)C(O[Si](C)(C)C)[C@H](O)C1O | 3040.1 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,1TMS,isomer #5 | COC1=C(O)C=C(C(=O)O)C=C1O[C@@H]1O[C@H](C(=O)O)C(O)[C@H](O[Si](C)(C)C)C1O | 3042.2 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,1TMS,isomer #6 | COC1=C(O)C=C(C(=O)O)C=C1O[C@@H]1O[C@H](C(=O)O)C(O)[C@H](O)C1O[Si](C)(C)C | 3043.5 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,2TMS,isomer #1 | COC1=C(O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C)C(O)[C@H](O)C2O)C=C(C(=O)O)C=C1O[Si](C)(C)C | 2988.0 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,2TMS,isomer #10 | COC1=C(O)C=C(C(=O)O)C=C1O[C@@H]1O[C@H](C(=O)O[Si](C)(C)C)C(O[Si](C)(C)C)[C@H](O)C1O | 2971.9 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,2TMS,isomer #11 | COC1=C(O)C=C(C(=O)O)C=C1O[C@@H]1O[C@H](C(=O)O[Si](C)(C)C)C(O)[C@H](O[Si](C)(C)C)C1O | 2957.3 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,2TMS,isomer #12 | COC1=C(O)C=C(C(=O)O)C=C1O[C@@H]1O[C@H](C(=O)O[Si](C)(C)C)C(O)[C@H](O)C1O[Si](C)(C)C | 2965.9 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,2TMS,isomer #13 | COC1=C(O)C=C(C(=O)O)C=C1O[C@@H]1O[C@H](C(=O)O)C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C1O | 3011.7 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,2TMS,isomer #14 | COC1=C(O)C=C(C(=O)O)C=C1O[C@@H]1O[C@H](C(=O)O)C(O[Si](C)(C)C)[C@H](O)C1O[Si](C)(C)C | 3009.5 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,2TMS,isomer #15 | COC1=C(O)C=C(C(=O)O)C=C1O[C@@H]1O[C@H](C(=O)O)C(O)[C@H](O[Si](C)(C)C)C1O[Si](C)(C)C | 3025.8 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,2TMS,isomer #2 | COC1=C(O[C@@H]2O[C@H](C(=O)O)C(O[Si](C)(C)C)[C@H](O)C2O)C=C(C(=O)O)C=C1O[Si](C)(C)C | 3037.0 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,2TMS,isomer #3 | COC1=C(O[C@@H]2O[C@H](C(=O)O)C(O)[C@H](O[Si](C)(C)C)C2O)C=C(C(=O)O)C=C1O[Si](C)(C)C | 3038.1 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,2TMS,isomer #4 | COC1=C(O[C@@H]2O[C@H](C(=O)O)C(O)[C@H](O)C2O[Si](C)(C)C)C=C(C(=O)O)C=C1O[Si](C)(C)C | 3033.2 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,2TMS,isomer #5 | COC1=C(O[C@@H]2O[C@H](C(=O)O)C(O)[C@H](O)C2O)C=C(C(=O)O[Si](C)(C)C)C=C1O[Si](C)(C)C | 2984.0 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,2TMS,isomer #6 | COC1=C(O)C=C(C(=O)O[Si](C)(C)C)C=C1O[C@@H]1O[C@H](C(=O)O[Si](C)(C)C)C(O)[C@H](O)C1O | 2937.7 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,2TMS,isomer #7 | COC1=C(O)C=C(C(=O)O[Si](C)(C)C)C=C1O[C@@H]1O[C@H](C(=O)O)C(O[Si](C)(C)C)[C@H](O)C1O | 2964.4 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,2TMS,isomer #8 | COC1=C(O)C=C(C(=O)O[Si](C)(C)C)C=C1O[C@@H]1O[C@H](C(=O)O)C(O)[C@H](O[Si](C)(C)C)C1O | 2958.9 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,2TMS,isomer #9 | COC1=C(O)C=C(C(=O)O[Si](C)(C)C)C=C1O[C@@H]1O[C@H](C(=O)O)C(O)[C@H](O)C1O[Si](C)(C)C | 2973.0 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,3TMS,isomer #1 | COC1=C(O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C)C(O[Si](C)(C)C)[C@H](O)C2O)C=C(C(=O)O)C=C1O[Si](C)(C)C | 2976.3 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,3TMS,isomer #10 | COC1=C(O[C@@H]2O[C@H](C(=O)O)C(O)[C@H](O)C2O[Si](C)(C)C)C=C(C(=O)O[Si](C)(C)C)C=C1O[Si](C)(C)C | 2945.4 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,3TMS,isomer #11 | COC1=C(O)C=C(C(=O)O[Si](C)(C)C)C=C1O[C@@H]1O[C@H](C(=O)O[Si](C)(C)C)C(O[Si](C)(C)C)[C@H](O)C1O | 2917.8 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,3TMS,isomer #12 | COC1=C(O)C=C(C(=O)O[Si](C)(C)C)C=C1O[C@@H]1O[C@H](C(=O)O[Si](C)(C)C)C(O)[C@H](O[Si](C)(C)C)C1O | 2893.3 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,3TMS,isomer #13 | COC1=C(O)C=C(C(=O)O[Si](C)(C)C)C=C1O[C@@H]1O[C@H](C(=O)O[Si](C)(C)C)C(O)[C@H](O)C1O[Si](C)(C)C | 2910.9 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,3TMS,isomer #14 | COC1=C(O)C=C(C(=O)O[Si](C)(C)C)C=C1O[C@@H]1O[C@H](C(=O)O)C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C1O | 2936.6 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,3TMS,isomer #15 | COC1=C(O)C=C(C(=O)O[Si](C)(C)C)C=C1O[C@@H]1O[C@H](C(=O)O)C(O[Si](C)(C)C)[C@H](O)C1O[Si](C)(C)C | 2950.0 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,3TMS,isomer #16 | COC1=C(O)C=C(C(=O)O[Si](C)(C)C)C=C1O[C@@H]1O[C@H](C(=O)O)C(O)[C@H](O[Si](C)(C)C)C1O[Si](C)(C)C | 2936.2 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,3TMS,isomer #17 | COC1=C(O)C=C(C(=O)O)C=C1O[C@@H]1O[C@H](C(=O)O[Si](C)(C)C)C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C1O | 2967.7 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,3TMS,isomer #18 | COC1=C(O)C=C(C(=O)O)C=C1O[C@@H]1O[C@H](C(=O)O[Si](C)(C)C)C(O[Si](C)(C)C)[C@H](O)C1O[Si](C)(C)C | 2973.4 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,3TMS,isomer #19 | COC1=C(O)C=C(C(=O)O)C=C1O[C@@H]1O[C@H](C(=O)O[Si](C)(C)C)C(O)[C@H](O[Si](C)(C)C)C1O[Si](C)(C)C | 2961.9 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,3TMS,isomer #2 | COC1=C(O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C)C(O)[C@H](O[Si](C)(C)C)C2O)C=C(C(=O)O)C=C1O[Si](C)(C)C | 2958.5 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,3TMS,isomer #20 | COC1=C(O)C=C(C(=O)O)C=C1O[C@@H]1O[C@H](C(=O)O)C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C1O[Si](C)(C)C | 3018.0 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,3TMS,isomer #3 | COC1=C(O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C)C(O)[C@H](O)C2O[Si](C)(C)C)C=C(C(=O)O)C=C1O[Si](C)(C)C | 2975.9 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,3TMS,isomer #4 | COC1=C(O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C)C(O)[C@H](O)C2O)C=C(C(=O)O[Si](C)(C)C)C=C1O[Si](C)(C)C | 2905.9 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,3TMS,isomer #5 | COC1=C(O[C@@H]2O[C@H](C(=O)O)C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C2O)C=C(C(=O)O)C=C1O[Si](C)(C)C | 3030.2 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,3TMS,isomer #6 | COC1=C(O[C@@H]2O[C@H](C(=O)O)C(O[Si](C)(C)C)[C@H](O)C2O[Si](C)(C)C)C=C(C(=O)O)C=C1O[Si](C)(C)C | 3024.4 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,3TMS,isomer #7 | COC1=C(O[C@@H]2O[C@H](C(=O)O)C(O[Si](C)(C)C)[C@H](O)C2O)C=C(C(=O)O[Si](C)(C)C)C=C1O[Si](C)(C)C | 2948.3 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,3TMS,isomer #8 | COC1=C(O[C@@H]2O[C@H](C(=O)O)C(O)[C@H](O[Si](C)(C)C)C2O[Si](C)(C)C)C=C(C(=O)O)C=C1O[Si](C)(C)C | 3024.0 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,3TMS,isomer #9 | COC1=C(O[C@@H]2O[C@H](C(=O)O)C(O)[C@H](O[Si](C)(C)C)C2O)C=C(C(=O)O[Si](C)(C)C)C=C1O[Si](C)(C)C | 2935.5 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,4TMS,isomer #1 | COC1=C(O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C)C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C2O)C=C(C(=O)O)C=C1O[Si](C)(C)C | 2992.8 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,4TMS,isomer #10 | COC1=C(O[C@@H]2O[C@H](C(=O)O)C(O)[C@H](O[Si](C)(C)C)C2O[Si](C)(C)C)C=C(C(=O)O[Si](C)(C)C)C=C1O[Si](C)(C)C | 2931.7 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,4TMS,isomer #11 | COC1=C(O)C=C(C(=O)O[Si](C)(C)C)C=C1O[C@@H]1O[C@H](C(=O)O[Si](C)(C)C)C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C1O | 2914.4 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,4TMS,isomer #12 | COC1=C(O)C=C(C(=O)O[Si](C)(C)C)C=C1O[C@@H]1O[C@H](C(=O)O[Si](C)(C)C)C(O[Si](C)(C)C)[C@H](O)C1O[Si](C)(C)C | 2935.3 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,4TMS,isomer #13 | COC1=C(O)C=C(C(=O)O[Si](C)(C)C)C=C1O[C@@H]1O[C@H](C(=O)O[Si](C)(C)C)C(O)[C@H](O[Si](C)(C)C)C1O[Si](C)(C)C | 2907.5 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,4TMS,isomer #14 | COC1=C(O)C=C(C(=O)O[Si](C)(C)C)C=C1O[C@@H]1O[C@H](C(=O)O)C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C1O[Si](C)(C)C | 2944.7 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,4TMS,isomer #15 | COC1=C(O)C=C(C(=O)O)C=C1O[C@@H]1O[C@H](C(=O)O[Si](C)(C)C)C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C1O[Si](C)(C)C | 2999.2 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,4TMS,isomer #2 | COC1=C(O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C)C(O[Si](C)(C)C)[C@H](O)C2O[Si](C)(C)C)C=C(C(=O)O)C=C1O[Si](C)(C)C | 2990.1 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,4TMS,isomer #3 | COC1=C(O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C)C(O[Si](C)(C)C)[C@H](O)C2O)C=C(C(=O)O[Si](C)(C)C)C=C1O[Si](C)(C)C | 2908.4 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,4TMS,isomer #4 | COC1=C(O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C)C(O)[C@H](O[Si](C)(C)C)C2O[Si](C)(C)C)C=C(C(=O)O)C=C1O[Si](C)(C)C | 2989.6 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,4TMS,isomer #5 | COC1=C(O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C)C(O)[C@H](O[Si](C)(C)C)C2O)C=C(C(=O)O[Si](C)(C)C)C=C1O[Si](C)(C)C | 2882.4 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,4TMS,isomer #6 | COC1=C(O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C)C(O)[C@H](O)C2O[Si](C)(C)C)C=C(C(=O)O[Si](C)(C)C)C=C1O[Si](C)(C)C | 2899.4 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,4TMS,isomer #7 | COC1=C(O[C@@H]2O[C@H](C(=O)O)C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C2O[Si](C)(C)C)C=C(C(=O)O)C=C1O[Si](C)(C)C | 3036.0 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,4TMS,isomer #8 | COC1=C(O[C@@H]2O[C@H](C(=O)O)C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C2O)C=C(C(=O)O[Si](C)(C)C)C=C1O[Si](C)(C)C | 2945.1 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,4TMS,isomer #9 | COC1=C(O[C@@H]2O[C@H](C(=O)O)C(O[Si](C)(C)C)[C@H](O)C2O[Si](C)(C)C)C=C(C(=O)O[Si](C)(C)C)C=C1O[Si](C)(C)C | 2953.4 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,5TMS,isomer #1 | COC1=C(O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C)C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C2O[Si](C)(C)C)C=C(C(=O)O)C=C1O[Si](C)(C)C | 3018.1 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,5TMS,isomer #2 | COC1=C(O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C)C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C2O)C=C(C(=O)O[Si](C)(C)C)C=C1O[Si](C)(C)C | 2944.4 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,5TMS,isomer #3 | COC1=C(O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C)C(O[Si](C)(C)C)[C@H](O)C2O[Si](C)(C)C)C=C(C(=O)O[Si](C)(C)C)C=C1O[Si](C)(C)C | 2951.0 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,5TMS,isomer #4 | COC1=C(O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C)C(O)[C@H](O[Si](C)(C)C)C2O[Si](C)(C)C)C=C(C(=O)O[Si](C)(C)C)C=C1O[Si](C)(C)C | 2930.1 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,5TMS,isomer #5 | COC1=C(O[C@@H]2O[C@H](C(=O)O)C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C2O[Si](C)(C)C)C=C(C(=O)O[Si](C)(C)C)C=C1O[Si](C)(C)C | 2941.2 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,5TMS,isomer #6 | COC1=C(O)C=C(C(=O)O[Si](C)(C)C)C=C1O[C@@H]1O[C@H](C(=O)O[Si](C)(C)C)C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C1O[Si](C)(C)C | 2961.6 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,6TMS,isomer #1 | COC1=C(O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C)C(O[Si](C)(C)C)[C@H](O[Si](C)(C)C)C2O[Si](C)(C)C)C=C(C(=O)O[Si](C)(C)C)C=C1O[Si](C)(C)C | 2973.7 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,1TBDMS,isomer #1 | COC1=C(O[C@@H]2O[C@H](C(=O)O)C(O)[C@H](O)C2O)C=C(C(=O)O)C=C1O[Si](C)(C)C(C)(C)C | 3316.1 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,1TBDMS,isomer #2 | COC1=C(O)C=C(C(=O)O[Si](C)(C)C(C)(C)C)C=C1O[C@@H]1O[C@H](C(=O)O)C(O)[C@H](O)C1O | 3324.1 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,1TBDMS,isomer #3 | COC1=C(O)C=C(C(=O)O)C=C1O[C@@H]1O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)C(O)[C@H](O)C1O | 3322.3 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,1TBDMS,isomer #4 | COC1=C(O)C=C(C(=O)O)C=C1O[C@@H]1O[C@H](C(=O)O)C(O[Si](C)(C)C(C)(C)C)[C@H](O)C1O | 3323.7 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,1TBDMS,isomer #5 | COC1=C(O)C=C(C(=O)O)C=C1O[C@@H]1O[C@H](C(=O)O)C(O)[C@H](O[Si](C)(C)C(C)(C)C)C1O | 3283.1 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,1TBDMS,isomer #6 | COC1=C(O)C=C(C(=O)O)C=C1O[C@@H]1O[C@H](C(=O)O)C(O)[C@H](O)C1O[Si](C)(C)C(C)(C)C | 3329.9 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,2TBDMS,isomer #1 | COC1=C(O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)C(O)[C@H](O)C2O)C=C(C(=O)O)C=C1O[Si](C)(C)C(C)(C)C | 3479.4 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,2TBDMS,isomer #10 | COC1=C(O)C=C(C(=O)O)C=C1O[C@@H]1O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)[C@H](O)C1O | 3495.7 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,2TBDMS,isomer #11 | COC1=C(O)C=C(C(=O)O)C=C1O[C@@H]1O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)C(O)[C@H](O[Si](C)(C)C(C)(C)C)C1O | 3452.6 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,2TBDMS,isomer #12 | COC1=C(O)C=C(C(=O)O)C=C1O[C@@H]1O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)C(O)[C@H](O)C1O[Si](C)(C)C(C)(C)C | 3487.0 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,2TBDMS,isomer #13 | COC1=C(O)C=C(C(=O)O)C=C1O[C@@H]1O[C@H](C(=O)O)C(O[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)C1O | 3464.9 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,2TBDMS,isomer #14 | COC1=C(O)C=C(C(=O)O)C=C1O[C@@H]1O[C@H](C(=O)O)C(O[Si](C)(C)C(C)(C)C)[C@H](O)C1O[Si](C)(C)C(C)(C)C | 3513.2 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,2TBDMS,isomer #15 | COC1=C(O)C=C(C(=O)O)C=C1O[C@@H]1O[C@H](C(=O)O)C(O)[C@H](O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C | 3471.4 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,2TBDMS,isomer #2 | COC1=C(O[C@@H]2O[C@H](C(=O)O)C(O[Si](C)(C)C(C)(C)C)[C@H](O)C2O)C=C(C(=O)O)C=C1O[Si](C)(C)C(C)(C)C | 3502.9 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,2TBDMS,isomer #3 | COC1=C(O[C@@H]2O[C@H](C(=O)O)C(O)[C@H](O[Si](C)(C)C(C)(C)C)C2O)C=C(C(=O)O)C=C1O[Si](C)(C)C(C)(C)C | 3464.7 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,2TBDMS,isomer #4 | COC1=C(O[C@@H]2O[C@H](C(=O)O)C(O)[C@H](O)C2O[Si](C)(C)C(C)(C)C)C=C(C(=O)O)C=C1O[Si](C)(C)C(C)(C)C | 3502.7 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,2TBDMS,isomer #5 | COC1=C(O[C@@H]2O[C@H](C(=O)O)C(O)[C@H](O)C2O)C=C(C(=O)O[Si](C)(C)C(C)(C)C)C=C1O[Si](C)(C)C(C)(C)C | 3487.4 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,2TBDMS,isomer #6 | COC1=C(O)C=C(C(=O)O[Si](C)(C)C(C)(C)C)C=C1O[C@@H]1O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)C(O)[C@H](O)C1O | 3464.1 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,2TBDMS,isomer #7 | COC1=C(O)C=C(C(=O)O[Si](C)(C)C(C)(C)C)C=C1O[C@@H]1O[C@H](C(=O)O)C(O[Si](C)(C)C(C)(C)C)[C@H](O)C1O | 3491.2 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,2TBDMS,isomer #8 | COC1=C(O)C=C(C(=O)O[Si](C)(C)C(C)(C)C)C=C1O[C@@H]1O[C@H](C(=O)O)C(O)[C@H](O[Si](C)(C)C(C)(C)C)C1O | 3479.8 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,2TBDMS,isomer #9 | COC1=C(O)C=C(C(=O)O[Si](C)(C)C(C)(C)C)C=C1O[C@@H]1O[C@H](C(=O)O)C(O)[C@H](O)C1O[Si](C)(C)C(C)(C)C | 3495.6 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,3TBDMS,isomer #1 | COC1=C(O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)[C@H](O)C2O)C=C(C(=O)O)C=C1O[Si](C)(C)C(C)(C)C | 3663.5 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,3TBDMS,isomer #10 | COC1=C(O[C@@H]2O[C@H](C(=O)O)C(O)[C@H](O)C2O[Si](C)(C)C(C)(C)C)C=C(C(=O)O[Si](C)(C)C(C)(C)C)C=C1O[Si](C)(C)C(C)(C)C | 3653.0 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,3TBDMS,isomer #11 | COC1=C(O)C=C(C(=O)O[Si](C)(C)C(C)(C)C)C=C1O[C@@H]1O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)[C@H](O)C1O | 3640.6 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,3TBDMS,isomer #12 | COC1=C(O)C=C(C(=O)O[Si](C)(C)C(C)(C)C)C=C1O[C@@H]1O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)C(O)[C@H](O[Si](C)(C)C(C)(C)C)C1O | 3633.4 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,3TBDMS,isomer #13 | COC1=C(O)C=C(C(=O)O[Si](C)(C)C(C)(C)C)C=C1O[C@@H]1O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)C(O)[C@H](O)C1O[Si](C)(C)C(C)(C)C | 3638.7 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,3TBDMS,isomer #14 | COC1=C(O)C=C(C(=O)O[Si](C)(C)C(C)(C)C)C=C1O[C@@H]1O[C@H](C(=O)O)C(O[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)C1O | 3631.2 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,3TBDMS,isomer #15 | COC1=C(O)C=C(C(=O)O[Si](C)(C)C(C)(C)C)C=C1O[C@@H]1O[C@H](C(=O)O)C(O[Si](C)(C)C(C)(C)C)[C@H](O)C1O[Si](C)(C)C(C)(C)C | 3653.0 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,3TBDMS,isomer #16 | COC1=C(O)C=C(C(=O)O[Si](C)(C)C(C)(C)C)C=C1O[C@@H]1O[C@H](C(=O)O)C(O)[C@H](O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C | 3642.7 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,3TBDMS,isomer #17 | COC1=C(O)C=C(C(=O)O)C=C1O[C@@H]1O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)C1O | 3630.5 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,3TBDMS,isomer #18 | COC1=C(O)C=C(C(=O)O)C=C1O[C@@H]1O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)[C@H](O)C1O[Si](C)(C)C(C)(C)C | 3670.1 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,3TBDMS,isomer #19 | COC1=C(O)C=C(C(=O)O)C=C1O[C@@H]1O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)C(O)[C@H](O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C | 3631.2 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,3TBDMS,isomer #2 | COC1=C(O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)C(O)[C@H](O[Si](C)(C)C(C)(C)C)C2O)C=C(C(=O)O)C=C1O[Si](C)(C)C(C)(C)C | 3644.4 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,3TBDMS,isomer #20 | COC1=C(O)C=C(C(=O)O)C=C1O[C@@H]1O[C@H](C(=O)O)C(O[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C | 3632.9 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,3TBDMS,isomer #3 | COC1=C(O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)C(O)[C@H](O)C2O[Si](C)(C)C(C)(C)C)C=C(C(=O)O)C=C1O[Si](C)(C)C(C)(C)C | 3659.7 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,3TBDMS,isomer #4 | COC1=C(O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)C(O)[C@H](O)C2O)C=C(C(=O)O[Si](C)(C)C(C)(C)C)C=C1O[Si](C)(C)C(C)(C)C | 3635.0 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,3TBDMS,isomer #5 | COC1=C(O[C@@H]2O[C@H](C(=O)O)C(O[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)C2O)C=C(C(=O)O)C=C1O[Si](C)(C)C(C)(C)C | 3646.0 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,3TBDMS,isomer #6 | COC1=C(O[C@@H]2O[C@H](C(=O)O)C(O[Si](C)(C)C(C)(C)C)[C@H](O)C2O[Si](C)(C)C(C)(C)C)C=C(C(=O)O)C=C1O[Si](C)(C)C(C)(C)C | 3669.8 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,3TBDMS,isomer #7 | COC1=C(O[C@@H]2O[C@H](C(=O)O)C(O[Si](C)(C)C(C)(C)C)[C@H](O)C2O)C=C(C(=O)O[Si](C)(C)C(C)(C)C)C=C1O[Si](C)(C)C(C)(C)C | 3653.3 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,3TBDMS,isomer #8 | COC1=C(O[C@@H]2O[C@H](C(=O)O)C(O)[C@H](O[Si](C)(C)C(C)(C)C)C2O[Si](C)(C)C(C)(C)C)C=C(C(=O)O)C=C1O[Si](C)(C)C(C)(C)C | 3649.4 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,3TBDMS,isomer #9 | COC1=C(O[C@@H]2O[C@H](C(=O)O)C(O)[C@H](O[Si](C)(C)C(C)(C)C)C2O)C=C(C(=O)O[Si](C)(C)C(C)(C)C)C=C1O[Si](C)(C)C(C)(C)C | 3652.5 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,4TBDMS,isomer #1 | COC1=C(O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)C2O)C=C(C(=O)O)C=C1O[Si](C)(C)C(C)(C)C | 3801.9 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,4TBDMS,isomer #10 | COC1=C(O[C@@H]2O[C@H](C(=O)O)C(O)[C@H](O[Si](C)(C)C(C)(C)C)C2O[Si](C)(C)C(C)(C)C)C=C(C(=O)O[Si](C)(C)C(C)(C)C)C=C1O[Si](C)(C)C(C)(C)C | 3785.0 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,4TBDMS,isomer #11 | COC1=C(O)C=C(C(=O)O[Si](C)(C)C(C)(C)C)C=C1O[C@@H]1O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)C1O | 3779.8 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,4TBDMS,isomer #12 | COC1=C(O)C=C(C(=O)O[Si](C)(C)C(C)(C)C)C=C1O[C@@H]1O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)[C@H](O)C1O[Si](C)(C)C(C)(C)C | 3814.9 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,4TBDMS,isomer #13 | COC1=C(O)C=C(C(=O)O[Si](C)(C)C(C)(C)C)C=C1O[C@@H]1O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)C(O)[C@H](O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C | 3776.0 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,4TBDMS,isomer #14 | COC1=C(O)C=C(C(=O)O[Si](C)(C)C(C)(C)C)C=C1O[C@@H]1O[C@H](C(=O)O)C(O[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C | 3784.5 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,4TBDMS,isomer #15 | COC1=C(O)C=C(C(=O)O)C=C1O[C@@H]1O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C | 3812.2 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,4TBDMS,isomer #2 | COC1=C(O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)[C@H](O)C2O[Si](C)(C)C(C)(C)C)C=C(C(=O)O)C=C1O[Si](C)(C)C(C)(C)C | 3836.6 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,4TBDMS,isomer #3 | COC1=C(O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)[C@H](O)C2O)C=C(C(=O)O[Si](C)(C)C(C)(C)C)C=C1O[Si](C)(C)C(C)(C)C | 3787.2 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,4TBDMS,isomer #4 | COC1=C(O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)C(O)[C@H](O[Si](C)(C)C(C)(C)C)C2O[Si](C)(C)C(C)(C)C)C=C(C(=O)O)C=C1O[Si](C)(C)C(C)(C)C | 3797.5 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,4TBDMS,isomer #5 | COC1=C(O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)C(O)[C@H](O[Si](C)(C)C(C)(C)C)C2O)C=C(C(=O)O[Si](C)(C)C(C)(C)C)C=C1O[Si](C)(C)C(C)(C)C | 3771.1 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,4TBDMS,isomer #6 | COC1=C(O[C@@H]2O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)C(O)[C@H](O)C2O[Si](C)(C)C(C)(C)C)C=C(C(=O)O[Si](C)(C)C(C)(C)C)C=C1O[Si](C)(C)C(C)(C)C | 3785.3 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,4TBDMS,isomer #7 | COC1=C(O[C@@H]2O[C@H](C(=O)O)C(O[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)C2O[Si](C)(C)C(C)(C)C)C=C(C(=O)O)C=C1O[Si](C)(C)C(C)(C)C | 3805.5 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,4TBDMS,isomer #8 | COC1=C(O[C@@H]2O[C@H](C(=O)O)C(O[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)C2O)C=C(C(=O)O[Si](C)(C)C(C)(C)C)C=C1O[Si](C)(C)C(C)(C)C | 3786.6 | Semi standard non polar | 33892256 |
| 4-Methylgallic acid 3-glucuronide,4TBDMS,isomer #9 | COC1=C(O[C@@H]2O[C@H](C(=O)O)C(O[Si](C)(C)C(C)(C)C)[C@H](O)C2O[Si](C)(C)C(C)(C)C)C=C(C(=O)O[Si](C)(C)C(C)(C)C)C=C1O[Si](C)(C)C(C)(C)C | 3805.8 | Semi standard non polar | 33892256 |