RI00001126 | Taurocholic acid,1TMS,isomer#1 | JsmolC[C@H](CCC(=O)NCCS(=O)(=O)O)[C@H]1CC[C@H]2[C@H]3[C@H](C[C@H](O)[C@@]21C)[C@@]1(C)CC[C@@H](O)C[C@H]1C[C@H]3O[Si](C)(C)C | TMS | 587.3312 | Semi standard non polar | 4179.115 |
RI00001127 | Taurocholic acid,1TMS,isomer#2 | JsmolC[C@H](CCC(=O)NCCS(=O)(=O)O)[C@H]1CC[C@H]2[C@H]3[C@H](C[C@H](O)[C@@]21C)[C@@]1(C)CC[C@@H](O[Si](C)(C)C)C[C@H]1C[C@H]3O | TMS | 587.3312 | Semi standard non polar | 4303.315 |
RI00001128 | Taurocholic acid,1TMS,isomer#3 | JsmolC[C@H](CCC(=O)NCCS(=O)(=O)O)[C@H]1CC[C@H]2[C@H]3[C@H](C[C@H](O[Si](C)(C)C)[C@@]21C)[C@@]1(C)CC[C@@H](O)C[C@H]1C[C@H]3O | TMS | 587.3312 | Semi standard non polar | 4263.106 |
RI00001129 | Taurocholic acid,1TMS,isomer#4 | JsmolC[C@H](CCC(=O)NCCS(=O)(=O)O[Si](C)(C)C)[C@H]1CC[C@H]2[C@H]3[C@H](C[C@H](O)[C@@]21C)[C@@]1(C)CC[C@@H](O)C[C@H]1C[C@H]3O | TMS | 587.3312 | Semi standard non polar | 4404.4688 |
RI00001130 | Taurocholic acid,1TMS,isomer#5 | JsmolC[C@H](CCC(=O)N(CCS(=O)(=O)O)[Si](C)(C)C)[C@H]1CC[C@H]2[C@H]3[C@H](C[C@H](O)[C@@]21C)[C@@]1(C)CC[C@@H](O)C[C@H]1C[C@H]3O | TMS | 587.3312 | Semi standard non polar | 4295.1235 |
RI00001131 | Taurocholic acid,2TMS,isomer#1 | JsmolC[C@H](CCC(=O)NCCS(=O)(=O)O)[C@H]1CC[C@H]2[C@H]3[C@H](C[C@H](O[Si](C)(C)C)[C@@]21C)[C@@]1(C)CC[C@@H](O)C[C@H]1C[C@H]3O[Si](C)(C)C | TMS | 659.3707 | Semi standard non polar | 4119.4307 |
RI00001132 | Taurocholic acid,2TMS,isomer#2 | JsmolC[C@H](CCC(=O)NCCS(=O)(=O)O)[C@H]1CC[C@H]2[C@H]3[C@H](C[C@H](O)[C@@]21C)[C@@]1(C)CC[C@@H](O[Si](C)(C)C)C[C@H]1C[C@H]3O[Si](C)(C)C | TMS | 659.3707 | Semi standard non polar | 4141.563 |
RI00001133 | Taurocholic acid,2TMS,isomer#3 | JsmolC[C@H](CCC(=O)NCCS(=O)(=O)O[Si](C)(C)C)[C@H]1CC[C@H]2[C@H]3[C@H](C[C@H](O)[C@@]21C)[C@@]1(C)CC[C@@H](O)C[C@H]1C[C@H]3O[Si](C)(C)C | TMS | 659.3707 | Semi standard non polar | 4216.6025 |
RI00001134 | Taurocholic acid,2TMS,isomer#4 | JsmolC[C@H](CCC(=O)N(CCS(=O)(=O)O)[Si](C)(C)C)[C@H]1CC[C@H]2[C@H]3[C@H](C[C@H](O)[C@@]21C)[C@@]1(C)CC[C@@H](O)C[C@H]1C[C@H]3O[Si](C)(C)C | TMS | 659.3707 | Semi standard non polar | 4103.891 |
RI00001135 | Taurocholic acid,2TMS,isomer#5 | JsmolC[C@H](CCC(=O)NCCS(=O)(=O)O)[C@H]1CC[C@H]2[C@H]3[C@H](C[C@H](O[Si](C)(C)C)[C@@]21C)[C@@]1(C)CC[C@@H](O[Si](C)(C)C)C[C@H]1C[C@H]3O | TMS | 659.3707 | Semi standard non polar | 4181.554 |
RI00001136 | Taurocholic acid,2TMS,isomer#6 | JsmolC[C@H](CCC(=O)NCCS(=O)(=O)O[Si](C)(C)C)[C@H]1CC[C@H]2[C@H]3[C@H](C[C@H](O)[C@@]21C)[C@@]1(C)CC[C@@H](O[Si](C)(C)C)C[C@H]1C[C@H]3O | TMS | 659.3707 | Semi standard non polar | 4359.2026 |
RI00001137 | Taurocholic acid,2TMS,isomer#7 | JsmolC[C@H](CCC(=O)N(CCS(=O)(=O)O)[Si](C)(C)C)[C@H]1CC[C@H]2[C@H]3[C@H](C[C@H](O)[C@@]21C)[C@@]1(C)CC[C@@H](O[Si](C)(C)C)C[C@H]1C[C@H]3O | TMS | 659.3707 | Semi standard non polar | 4248.6553 |
RI00001138 | Taurocholic acid,2TMS,isomer#8 | JsmolC[C@H](CCC(=O)NCCS(=O)(=O)O[Si](C)(C)C)[C@H]1CC[C@H]2[C@H]3[C@H](C[C@H](O[Si](C)(C)C)[C@@]21C)[C@@]1(C)CC[C@@H](O)C[C@H]1C[C@H]3O | TMS | 659.3707 | Semi standard non polar | 4303.986 |
RI00001139 | Taurocholic acid,2TMS,isomer#9 | JsmolC[C@H](CCC(=O)N(CCS(=O)(=O)O)[Si](C)(C)C)[C@H]1CC[C@H]2[C@H]3[C@H](C[C@H](O[Si](C)(C)C)[C@@]21C)[C@@]1(C)CC[C@@H](O)C[C@H]1C[C@H]3O | TMS | 659.3707 | Semi standard non polar | 4184.308 |
RI00001140 | Taurocholic acid,2TMS,isomer#10 | JsmolC[C@H](CCC(=O)N(CCS(=O)(=O)O[Si](C)(C)C)[Si](C)(C)C)[C@H]1CC[C@H]2[C@H]3[C@H](C[C@H](O)[C@@]21C)[C@@]1(C)CC[C@@H](O)C[C@H]1C[C@H]3O | TMS | 659.3707 | Semi standard non polar | 4379.5547 |
RI00001141 | Taurocholic acid,3TMS,isomer#1 | JsmolC[C@H](CCC(=O)NCCS(=O)(=O)O)[C@H]1CC[C@H]2[C@H]3[C@H](C[C@H](O[Si](C)(C)C)[C@@]21C)[C@@]1(C)CC[C@@H](O[Si](C)(C)C)C[C@H]1C[C@H]3O[Si](C)(C)C | TMS | 731.4103 | Semi standard non polar | 4087.2832 |
RI00001142 | Taurocholic acid,3TMS,isomer#2 | JsmolC[C@H](CCC(=O)NCCS(=O)(=O)O[Si](C)(C)C)[C@H]1CC[C@H]2[C@H]3[C@H](C[C@H](O[Si](C)(C)C)[C@@]21C)[C@@]1(C)CC[C@@H](O)C[C@H]1C[C@H]3O[Si](C)(C)C | TMS | 731.4103 | Semi standard non polar | 4164.47 |
RI00001143 | Taurocholic acid,3TMS,isomer#3 | JsmolC[C@H](CCC(=O)N(CCS(=O)(=O)O)[Si](C)(C)C)[C@H]1CC[C@H]2[C@H]3[C@H](C[C@H](O[Si](C)(C)C)[C@@]21C)[C@@]1(C)CC[C@@H](O)C[C@H]1C[C@H]3O[Si](C)(C)C | TMS | 731.4103 | Semi standard non polar | 4054.4365 |
RI00001144 | Taurocholic acid,3TMS,isomer#4 | JsmolC[C@H](CCC(=O)NCCS(=O)(=O)O[Si](C)(C)C)[C@H]1CC[C@H]2[C@H]3[C@H](C[C@H](O)[C@@]21C)[C@@]1(C)CC[C@@H](O[Si](C)(C)C)C[C@H]1C[C@H]3O[Si](C)(C)C | TMS | 731.4103 | Semi standard non polar | 4180.065 |
RI00001145 | Taurocholic acid,3TMS,isomer#5 | JsmolC[C@H](CCC(=O)N(CCS(=O)(=O)O)[Si](C)(C)C)[C@H]1CC[C@H]2[C@H]3[C@H](C[C@H](O)[C@@]21C)[C@@]1(C)CC[C@@H](O[Si](C)(C)C)C[C@H]1C[C@H]3O[Si](C)(C)C | TMS | 731.4103 | Semi standard non polar | 4069.0676 |
RI00001146 | Taurocholic acid,3TMS,isomer#6 | JsmolC[C@H](CCC(=O)N(CCS(=O)(=O)O[Si](C)(C)C)[Si](C)(C)C)[C@H]1CC[C@H]2[C@H]3[C@H](C[C@H](O)[C@@]21C)[C@@]1(C)CC[C@@H](O)C[C@H]1C[C@H]3O[Si](C)(C)C | TMS | 731.4103 | Semi standard non polar | 4170.4443 |
RI00001147 | Taurocholic acid,3TMS,isomer#7 | JsmolC[C@H](CCC(=O)NCCS(=O)(=O)O[Si](C)(C)C)[C@H]1CC[C@H]2[C@H]3[C@H](C[C@H](O[Si](C)(C)C)[C@@]21C)[C@@]1(C)CC[C@@H](O[Si](C)(C)C)C[C@H]1C[C@H]3O | TMS | 731.4103 | Semi standard non polar | 4209.0566 |
RI00001148 | Taurocholic acid,3TMS,isomer#8 | JsmolC[C@H](CCC(=O)N(CCS(=O)(=O)O)[Si](C)(C)C)[C@H]1CC[C@H]2[C@H]3[C@H](C[C@H](O[Si](C)(C)C)[C@@]21C)[C@@]1(C)CC[C@@H](O[Si](C)(C)C)C[C@H]1C[C@H]3O | TMS | 731.4103 | Semi standard non polar | 4106.4307 |
RI00001149 | Taurocholic acid,3TMS,isomer#9 | JsmolC[C@H](CCC(=O)N(CCS(=O)(=O)O[Si](C)(C)C)[Si](C)(C)C)[C@H]1CC[C@H]2[C@H]3[C@H](C[C@H](O)[C@@]21C)[C@@]1(C)CC[C@@H](O[Si](C)(C)C)C[C@H]1C[C@H]3O | TMS | 731.4103 | Semi standard non polar | 4299.906 |
RI00001150 | Taurocholic acid,3TMS,isomer#10 | JsmolC[C@H](CCC(=O)N(CCS(=O)(=O)O[Si](C)(C)C)[Si](C)(C)C)[C@H]1CC[C@H]2[C@H]3[C@H](C[C@H](O[Si](C)(C)C)[C@@]21C)[C@@]1(C)CC[C@@H](O)C[C@H]1C[C@H]3O | TMS | 731.4103 | Semi standard non polar | 4239.7153 |