RI00019651 | 7-Ketodeoxycholic acid,2TBDMS,isomer#3 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)[C@H]1CC[C@H]2C3=C(O[Si](C)(C)C(C)(C)C)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3C[C@H](O)[C@@]21C | TBDMS | 634.4449 | Semi standard non polar | 3772.9639 |
RI00019652 | 7-Ketodeoxycholic acid,2TBDMS,isomer#4 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)[C@H]1CC[C@H]2[C@@H]3C(O[Si](C)(C)C(C)(C)C)=C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3C[C@H](O)[C@@]21C | TBDMS | 634.4449 | Semi standard non polar | 3714.0693 |
RI00019653 | 7-Ketodeoxycholic acid,2TBDMS,isomer#5 | JsmolC[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3C(=O)C[C@@H]4C[C@H](O[Si](C)(C)C(C)(C)C)CC[C@]4(C)[C@H]3C[C@H](O[Si](C)(C)C(C)(C)C)[C@@]21C | TBDMS | 634.4449 | Semi standard non polar | 3840.2588 |
RI00019654 | 7-Ketodeoxycholic acid,2TBDMS,isomer#6 | JsmolC[C@H](CCC(=O)O)[C@H]1CC[C@H]2C3=C(O[Si](C)(C)C(C)(C)C)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3C[C@H](O[Si](C)(C)C(C)(C)C)[C@@]21C | TBDMS | 634.4449 | Semi standard non polar | 3788.2512 |
RI00019655 | 7-Ketodeoxycholic acid,2TBDMS,isomer#7 | JsmolC[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3C(O[Si](C)(C)C(C)(C)C)=C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3C[C@H](O[Si](C)(C)C(C)(C)C)[C@@]21C | TBDMS | 634.4449 | Semi standard non polar | 3741.3337 |
RI00019656 | 7-Ketodeoxycholic acid,2TBDMS,isomer#8 | JsmolC[C@H](CCC(=O)O)[C@H]1CC[C@H]2C3=C(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@H](O)[C@@]21C | TBDMS | 634.4449 | Semi standard non polar | 3778.6611 |
RI00019657 | 7-Ketodeoxycholic acid,2TBDMS,isomer#9 | JsmolC[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3C(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@H](O)[C@@]21C | TBDMS | 634.4449 | Semi standard non polar | 3720.243 |
RI00019658 | 7-Ketodeoxycholic 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]3C(=O)C[C@@H]4C[C@H](O[Si](C)(C)C(C)(C)C)CC[C@]4(C)[C@H]3C[C@H](O[Si](C)(C)C(C)(C)C)[C@@]21C | TBDMS | 748.5314 | Semi standard non polar | 4064.1768 |
RI00019659 | 7-Ketodeoxycholic acid,3TBDMS,isomer#2 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)[C@H]1CC[C@H]2C3=C(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@H](O)[C@@]21C | TBDMS | 748.5314 | Semi standard non polar | 3954.2231 |
RI00019660 | 7-Ketodeoxycholic 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]3C(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@H](O)[C@@]21C | TBDMS | 748.5314 | Semi standard non polar | 3896.7966 |
RI00019661 | 7-Ketodeoxycholic acid,3TBDMS,isomer#4 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)[C@H]1CC[C@H]2C3=C(O[Si](C)(C)C(C)(C)C)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3C[C@H](O[Si](C)(C)C(C)(C)C)[C@@]21C | TBDMS | 748.5314 | Semi standard non polar | 3974.958 |
RI00019662 | 7-Ketodeoxycholic acid,3TBDMS,isomer#5 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)[C@H]1CC[C@H]2[C@@H]3C(O[Si](C)(C)C(C)(C)C)=C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3C[C@H](O[Si](C)(C)C(C)(C)C)[C@@]21C | TBDMS | 748.5314 | Semi standard non polar | 3918.181 |
RI00019663 | 7-Ketodeoxycholic acid,3TBDMS,isomer#6 | JsmolC[C@H](CCC(=O)O)[C@H]1CC[C@H]2C3=C(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@H](O[Si](C)(C)C(C)(C)C)[C@@]21C | TBDMS | 748.5314 | Semi standard non polar | 3979.134 |
RI00019664 | 7-Ketodeoxycholic acid,3TBDMS,isomer#7 | JsmolC[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3C(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@H](O[Si](C)(C)C(C)(C)C)[C@@]21C | TBDMS | 748.5314 | Semi standard non polar | 3926.8286 |
RI00019665 | 7-Ketodeoxycholic acid | Jsmol[H][C@@]12CC[C@H]([C@H](C)CCC(O)=O)[C@@]1(C)[C@@H](O)C[C@@]1([H])[C@@]2([H])C(=O)C[C@]2([H])C[C@H](O)CC[C@]12C | Underivatized | 406.2719 | Standard polar | 4018.874 |
RI00019666 | 7-Ketodeoxycholic acid,4TMS,isomer#1 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C)[C@H]1CC[C@H]2C3=C(O[Si](C)(C)C)C[C@@H]4C[C@H](O[Si](C)(C)C)CC[C@]4(C)[C@H]3C[C@H](O[Si](C)(C)C)[C@@]21C | TMS | 694.43 | Standard non polar | 3369.823 |
RI00019667 | 7-Ketodeoxycholic acid,4TMS,isomer#2 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C)[C@H]1CC[C@H]2[C@@H]3C(O[Si](C)(C)C)=C[C@@H]4C[C@H](O[Si](C)(C)C)CC[C@]4(C)[C@H]3C[C@H](O[Si](C)(C)C)[C@@]21C | TMS | 694.43 | Standard non polar | 3313.399 |
RI00019668 | 7-Ketodeoxycholic acid,4TBDMS,isomer#1 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)[C@H]1CC[C@H]2C3=C(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@H](O[Si](C)(C)C(C)(C)C)[C@@]21C | TBDMS | 862.6178 | Standard non polar | 4050.5674 |
RI00019669 | 7-Ketodeoxycholic acid,4TBDMS,isomer#2 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)[C@H]1CC[C@H]2[C@@H]3C(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@H](O[Si](C)(C)C(C)(C)C)[C@@]21C | TBDMS | 862.6178 | Standard non polar | 3837.5684 |
RI00019670 | 7-Ketodeoxycholic acid | Jsmol[H][C@@]12CC[C@H]([C@H](C)CCC(O)=O)[C@@]1(C)[C@@H](O)C[C@@]1([H])[C@@]2([H])C(=O)C[C@]2([H])C[C@H](O)CC[C@]12C | Underivatized | 406.2719 | Standard non polar | 3429.0745 |
RI00019671 | 7-Ketodeoxycholic acid | Jsmol[H][C@@]12CC[C@H]([C@H](C)CCC(O)=O)[C@@]1(C)[C@@H](O)C[C@@]1([H])[C@@]2([H])C(=O)C[C@]2([H])C[C@H](O)CC[C@]12C | Underivatized | 406.2719 | Semi standard non polar | 3683.1685 |
RI00019672 | 7-Ketodeoxycholic acid,4TMS,isomer#1 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C)[C@H]1CC[C@H]2C3=C(O[Si](C)(C)C)C[C@@H]4C[C@H](O[Si](C)(C)C)CC[C@]4(C)[C@H]3C[C@H](O[Si](C)(C)C)[C@@]21C | TMS | 694.43 | Semi standard non polar | 3342.0461 |
RI00019673 | 7-Ketodeoxycholic acid,4TMS,isomer#2 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C)[C@H]1CC[C@H]2[C@@H]3C(O[Si](C)(C)C)=C[C@@H]4C[C@H](O[Si](C)(C)C)CC[C@]4(C)[C@H]3C[C@H](O[Si](C)(C)C)[C@@]21C | TMS | 694.43 | Semi standard non polar | 3296.522 |
RI00019674 | 7-Ketodeoxycholic acid,4TBDMS,isomer#1 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)[C@H]1CC[C@H]2C3=C(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@H](O[Si](C)(C)C(C)(C)C)[C@@]21C | TBDMS | 862.6178 | Semi standard non polar | 4171.737 |
RI00019675 | 7-Ketodeoxycholic acid,4TBDMS,isomer#2 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)[C@H]1CC[C@H]2[C@@H]3C(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@H](O[Si](C)(C)C(C)(C)C)[C@@]21C | TBDMS | 862.6178 | Semi standard non polar | 4123.5054 |