RI00019876 | 3,7-Dihydroxy-12-oxocholanoic acid,3TMS,isomer#2 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4C[C@H](O[Si](C)(C)C)CC[C@]4(C)[C@H]3C=C(O[Si](C)(C)C)[C@@]21C | TMS | 622.3905 | Semi standard non polar | 3271.7876 |
RI00019877 | 3,7-Dihydroxy-12-oxocholanoic acid,3TMS,isomer#3 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C)[C@H]1CC[C@H]2[C@@H]3[C@H](O[Si](C)(C)C)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3C=C(O[Si](C)(C)C)[C@@]21C | TMS | 622.3905 | Semi standard non polar | 3247.3066 |
RI00019878 | 3,7-Dihydroxy-12-oxocholanoic acid,3TMS,isomer#4 | JsmolC[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@H](O[Si](C)(C)C)C[C@@H]4C[C@H](O[Si](C)(C)C)CC[C@]4(C)[C@H]3C=C(O[Si](C)(C)C)[C@@]21C | TMS | 622.3905 | Semi standard non polar | 3219.1045 |
RI00019879 | 3,7-Dihydroxy-12-oxocholanoic acid,1TBDMS,isomer#1 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)[C@H]1CC[C@H]2[C@H]3[C@H](CC(=O)[C@@]21C)[C@@]1(C)CC[C@@H](O)C[C@H]1C[C@H]3O | TBDMS | 520.3584 | Semi standard non polar | 3720.35 |
RI00019880 | 3,7-Dihydroxy-12-oxocholanoic acid,1TBDMS,isomer#2 | JsmolC[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@H]3[C@H](CC(=O)[C@@]21C)[C@@]1(C)CC[C@@H](O)C[C@H]1C[C@H]3O[Si](C)(C)C(C)(C)C | TBDMS | 520.3584 | Semi standard non polar | 3611.268 |
RI00019881 | 3,7-Dihydroxy-12-oxocholanoic acid,1TBDMS,isomer#3 | JsmolC[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@H]3[C@H](CC(=O)[C@@]21C)[C@@]1(C)CC[C@@H](O[Si](C)(C)C(C)(C)C)C[C@H]1C[C@H]3O | TBDMS | 520.3584 | Semi standard non polar | 3677.5674 |
RI00019882 | 3,7-Dihydroxy-12-oxocholanoic acid,1TBDMS,isomer#4 | JsmolC[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3C=C(O[Si](C)(C)C(C)(C)C)[C@@]21C | TBDMS | 520.3584 | Semi standard non polar | 3571.4211 |
RI00019883 | 3,7-Dihydroxy-12-oxocholanoic acid,2TBDMS,isomer#1 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)[C@H]1CC[C@H]2[C@H]3[C@H](CC(=O)[C@@]21C)[C@@]1(C)CC[C@@H](O[Si](C)(C)C(C)(C)C)C[C@H]1C[C@H]3O | TBDMS | 634.4449 | Semi standard non polar | 3903.863 |
RI00019884 | 3,7-Dihydroxy-12-oxocholanoic acid,2TBDMS,isomer#2 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)[C@H]1CC[C@H]2[C@H]3[C@H](CC(=O)[C@@]21C)[C@@]1(C)CC[C@@H](O)C[C@H]1C[C@H]3O[Si](C)(C)C(C)(C)C | TBDMS | 634.4449 | Semi standard non polar | 3817.2385 |
RI00019885 | 3,7-Dihydroxy-12-oxocholanoic acid,2TBDMS,isomer#3 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3C=C(O[Si](C)(C)C(C)(C)C)[C@@]21C | TBDMS | 634.4449 | Semi standard non polar | 3776.9507 |
RI00019886 | 3,7-Dihydroxy-12-oxocholanoic acid,2TBDMS,isomer#4 | JsmolC[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@H]3[C@H](CC(=O)[C@@]21C)[C@@]1(C)CC[C@@H](O[Si](C)(C)C(C)(C)C)C[C@H]1C[C@H]3O[Si](C)(C)C(C)(C)C | TBDMS | 634.4449 | Semi standard non polar | 3788.5376 |
RI00019887 | 3,7-Dihydroxy-12-oxocholanoic acid,2TBDMS,isomer#5 | JsmolC[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@H](O[Si](C)(C)C(C)(C)C)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3C=C(O[Si](C)(C)C(C)(C)C)[C@@]21C | TBDMS | 634.4449 | Semi standard non polar | 3686.7664 |
RI00019888 | 3,7-Dihydroxy-12-oxocholanoic acid,2TBDMS,isomer#6 | JsmolC[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4C[C@H](O[Si](C)(C)C(C)(C)C)CC[C@]4(C)[C@H]3C=C(O[Si](C)(C)C(C)(C)C)[C@@]21C | TBDMS | 634.4449 | Semi standard non polar | 3695.8394 |
RI00019889 | 3,7-Dihydroxy-12-oxocholanoic acid,3TBDMS,isomer#1 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)[C@H]1CC[C@H]2[C@H]3[C@H](CC(=O)[C@@]21C)[C@@]1(C)CC[C@@H](O[Si](C)(C)C(C)(C)C)C[C@H]1C[C@H]3O[Si](C)(C)C(C)(C)C | TBDMS | 748.5314 | Semi standard non polar | 4013.6326 |
RI00019890 | 3,7-Dihydroxy-12-oxocholanoic acid,3TBDMS,isomer#2 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4C[C@H](O[Si](C)(C)C(C)(C)C)CC[C@]4(C)[C@H]3C=C(O[Si](C)(C)C(C)(C)C)[C@@]21C | TBDMS | 748.5314 | Semi standard non polar | 3914.116 |
RI00019891 | 3,7-Dihydroxy-12-oxocholanoic acid,3TBDMS,isomer#3 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)[C@H]1CC[C@H]2[C@@H]3[C@H](O[Si](C)(C)C(C)(C)C)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3C=C(O[Si](C)(C)C(C)(C)C)[C@@]21C | TBDMS | 748.5314 | Semi standard non polar | 3894.9922 |
RI00019892 | 3,7-Dihydroxy-12-oxocholanoic acid,3TBDMS,isomer#4 | JsmolC[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@H](O[Si](C)(C)C(C)(C)C)C[C@@H]4C[C@H](O[Si](C)(C)C(C)(C)C)CC[C@]4(C)[C@H]3C=C(O[Si](C)(C)C(C)(C)C)[C@@]21C | TBDMS | 748.5314 | Semi standard non polar | 3878.1782 |
RI00019893 | 3,7-Dihydroxy-12-oxocholanoic acid | Jsmol[H][C@@]12CC[C@H]([C@H](C)CCC(O)=O)[C@@]1(C)C(=O)C[C@@]1([H])[C@@]2([H])[C@H](O)C[C@]2([H])C[C@H](O)CC[C@]12C | Underivatized | 406.2719 | Standard polar | 3891.6082 |
RI00019894 | 3,7-Dihydroxy-12-oxocholanoic acid,4TMS,isomer#1 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C)[C@H]1CC[C@H]2[C@@H]3[C@H](O[Si](C)(C)C)C[C@@H]4C[C@H](O[Si](C)(C)C)CC[C@]4(C)[C@H]3C=C(O[Si](C)(C)C)[C@@]21C | TMS | 694.43 | Standard non polar | 3275.709 |
RI00019895 | 3,7-Dihydroxy-12-oxocholanoic acid,4TBDMS,isomer#1 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)[C@H]1CC[C@H]2[C@@H]3[C@H](O[Si](C)(C)C(C)(C)C)C[C@@H]4C[C@H](O[Si](C)(C)C(C)(C)C)CC[C@]4(C)[C@H]3C=C(O[Si](C)(C)C(C)(C)C)[C@@]21C | TBDMS | 862.6178 | Standard non polar | 3791.3774 |
RI00019896 | 3,7-Dihydroxy-12-oxocholanoic acid | Jsmol[H][C@@]12CC[C@H]([C@H](C)CCC(O)=O)[C@@]1(C)C(=O)C[C@@]1([H])[C@@]2([H])[C@H](O)C[C@]2([H])C[C@H](O)CC[C@]12C | Underivatized | 406.2719 | Standard non polar | 3438.503 |
RI00019897 | 3,7-Dihydroxy-12-oxocholanoic acid | Jsmol[H][C@@]12CC[C@H]([C@H](C)CCC(O)=O)[C@@]1(C)C(=O)C[C@@]1([H])[C@@]2([H])[C@H](O)C[C@]2([H])C[C@H](O)CC[C@]12C | Underivatized | 406.2719 | Semi standard non polar | 3649.5027 |
RI00019898 | 3,7-Dihydroxy-12-oxocholanoic acid,4TMS,isomer#1 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C)[C@H]1CC[C@H]2[C@@H]3[C@H](O[Si](C)(C)C)C[C@@H]4C[C@H](O[Si](C)(C)C)CC[C@]4(C)[C@H]3C=C(O[Si](C)(C)C)[C@@]21C | TMS | 694.43 | Semi standard non polar | 3245.1604 |
RI00019899 | 3,7-Dihydroxy-12-oxocholanoic acid,4TBDMS,isomer#1 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)[C@H]1CC[C@H]2[C@@H]3[C@H](O[Si](C)(C)C(C)(C)C)C[C@@H]4C[C@H](O[Si](C)(C)C(C)(C)C)CC[C@]4(C)[C@H]3C=C(O[Si](C)(C)C(C)(C)C)[C@@]21C | TBDMS | 862.6178 | Semi standard non polar | 4087.5347 |
RI00019900 | 3,7-Dihydroxy-12-oxocholanoic acid,4TMS,isomer#1 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C)[C@H]1CC[C@H]2[C@@H]3[C@H](O[Si](C)(C)C)C[C@@H]4C[C@H](O[Si](C)(C)C)CC[C@]4(C)[C@H]3C=C(O[Si](C)(C)C)[C@@]21C | TMS | 694.43 | Standard polar | 3550.5854 |