RI00017601 | 3alpha,7alpha,12beta-Trihydroxy-5beta-cholanoic 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]3[C@H](C[C@@H](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 | 636.4605 | Semi standard non polar | 3849.5317 |
RI00017602 | 3alpha,7alpha,12beta-Trihydroxy-5beta-cholanoic acid,2TBDMS,isomer#5 | JsmolC[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@H]3[C@H](C[C@@H](O[Si](C)(C)C(C)(C)C)[C@@]21C)[C@@]1(C)CC[C@@H](O[Si](C)(C)C(C)(C)C)C[C@H]1C[C@H]3O | TBDMS | 636.4605 | Semi standard non polar | 3798.591 |
RI00017603 | 3alpha,7alpha,12beta-Trihydroxy-5beta-cholanoic acid,2TBDMS,isomer#6 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)[C@H]1CC[C@H]2[C@H]3[C@H](C[C@@H](O[Si](C)(C)C(C)(C)C)[C@@]21C)[C@@]1(C)CC[C@@H](O)C[C@H]1C[C@H]3O | TBDMS | 636.4605 | Semi standard non polar | 3838.8474 |
RI00017604 | 3alpha,7alpha,12beta-Trihydroxy-5beta-cholanoic 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](C[C@@H](O[Si](C)(C)C(C)(C)C)[C@@]21C)[C@@]1(C)CC[C@@H](O)C[C@H]1C[C@H]3O[Si](C)(C)C(C)(C)C | TBDMS | 750.547 | Semi standard non polar | 3958.4512 |
RI00017605 | 3alpha,7alpha,12beta-Trihydroxy-5beta-cholanoic 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](C[C@@H](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 | 750.547 | Semi standard non polar | 3941.7725 |
RI00017606 | 3alpha,7alpha,12beta-Trihydroxy-5beta-cholanoic acid,3TBDMS,isomer#3 | JsmolC[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@H]3[C@H](C[C@@H](O[Si](C)(C)C(C)(C)C)[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 | 750.547 | Semi standard non polar | 3967.2468 |
RI00017607 | 3alpha,7alpha,12beta-Trihydroxy-5beta-cholanoic acid,3TBDMS,isomer#4 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)[C@H]1CC[C@H]2[C@H]3[C@H](C[C@@H](O[Si](C)(C)C(C)(C)C)[C@@]21C)[C@@]1(C)CC[C@@H](O[Si](C)(C)C(C)(C)C)C[C@H]1C[C@H]3O | TBDMS | 750.547 | Semi standard non polar | 3986.646 |
RI00017608 | 3alpha,7alpha,12beta-Trihydroxy-5beta-cholanoic 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](C[C@@H](O[Si](C)(C)C(C)(C)C)[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 | 864.6335 | Semi standard non polar | 4162.0063 |
RI00017609 | 3alpha,7alpha,12beta-Trihydroxy-5beta-cholanoic acid | Jsmol[H][C@@]1(CC[C@@]2([H])[C@]3([H])[C@H](O)C[C@]4([H])C[C@H](O)CC[C@]4(C)[C@@]3([H])C[C@@H](O)[C@]12C)[C@H](C)CCC(O)=O | Underivatized | 408.2876 | Standard polar | 4216.655 |
RI00017610 | 3alpha,7alpha,12beta-Trihydroxy-5beta-cholanoic acid | Jsmol[H][C@@]1(CC[C@@]2([H])[C@]3([H])[C@H](O)C[C@]4([H])C[C@H](O)CC[C@]4(C)[C@@]3([H])C[C@@H](O)[C@]12C)[C@H](C)CCC(O)=O | Underivatized | 408.2876 | Standard non polar | 3464.1238 |
RI00017611 | 3alpha,7alpha,12beta-Trihydroxy-5beta-cholanoic acid | Jsmol[H][C@@]1(CC[C@@]2([H])[C@]3([H])[C@H](O)C[C@]4([H])C[C@H](O)CC[C@]4(C)[C@@]3([H])C[C@@H](O)[C@]12C)[C@H](C)CCC(O)=O | Underivatized | 408.2876 | Semi standard non polar | 3681.9438 |
RI00017612 | 16b-Hydroxyestrone,1TMS,isomer#1 | JsmolC[C@]12CC[C@@H]3C4=CC=C(O)C=C4CC[C@H]3[C@@H]1C[C@H](O[Si](C)(C)C)C2=O | TMS | 358.1964 | Semi standard non polar | 2768.0334 |
RI00017613 | 16b-Hydroxyestrone,1TMS,isomer#2 | JsmolC[C@]12CC[C@@H]3C4=CC=C(O[Si](C)(C)C)C=C4CC[C@H]3[C@@H]1C[C@H](O)C2=O | TMS | 358.1964 | Semi standard non polar | 2786.1277 |
RI00017614 | 16b-Hydroxyestrone,1TMS,isomer#3 | JsmolC[C@]12CC[C@@H]3C4=CC=C(O)C=C4CC[C@H]3[C@@H]1CC(O)=C2O[Si](C)(C)C | TMS | 358.1964 | Semi standard non polar | 2768.1338 |
RI00017615 | 16b-Hydroxyestrone,2TMS,isomer#1 | JsmolC[C@]12CC[C@@H]3C4=CC=C(O[Si](C)(C)C)C=C4CC[C@H]3[C@@H]1C[C@H](O[Si](C)(C)C)C2=O | TMS | 430.2359 | Semi standard non polar | 2875.1064 |
RI00017616 | 16b-Hydroxyestrone,2TMS,isomer#2 | JsmolC[C@]12CC[C@@H]3C4=CC=C(O)C=C4CC[C@H]3[C@@H]1CC(O[Si](C)(C)C)=C2O[Si](C)(C)C | TMS | 430.2359 | Semi standard non polar | 2779.4495 |
RI00017617 | 16b-Hydroxyestrone,2TMS,isomer#3 | JsmolC[C@]12CC[C@@H]3C4=CC=C(O[Si](C)(C)C)C=C4CC[C@H]3[C@@H]1CC(O)=C2O[Si](C)(C)C | TMS | 430.2359 | Semi standard non polar | 2838.9927 |
RI00017618 | 16b-Hydroxyestrone,1TBDMS,isomer#1 | JsmolCC(C)(C)[Si](C)(C)O[C@H]1C[C@H]2[C@@H]3CCC4=CC(O)=CC=C4[C@H]3CC[C@]2(C)C1=O | TBDMS | 400.2434 | Semi standard non polar | 3049.548 |
RI00017619 | 16b-Hydroxyestrone,1TBDMS,isomer#2 | JsmolCC(C)(C)[Si](C)(C)OC1=CC=C2C(=C1)CC[C@@H]1[C@@H]2CC[C@]2(C)C(=O)[C@@H](O)C[C@@H]12 | TBDMS | 400.2434 | Semi standard non polar | 3088.4634 |
RI00017620 | 16b-Hydroxyestrone,1TBDMS,isomer#3 | JsmolCC(C)(C)[Si](C)(C)OC1=C(O)C[C@H]2[C@@H]3CCC4=CC(O)=CC=C4[C@H]3CC[C@]12C | TBDMS | 400.2434 | Semi standard non polar | 3043.648 |
RI00017621 | 16b-Hydroxyestrone,2TBDMS,isomer#1 | JsmolCC(C)(C)[Si](C)(C)OC1=CC=C2C(=C1)CC[C@@H]1[C@@H]2CC[C@]2(C)C(=O)[C@@H](O[Si](C)(C)C(C)(C)C)C[C@@H]12 | TBDMS | 514.3298 | Semi standard non polar | 3412.7769 |
RI00017622 | 16b-Hydroxyestrone,2TBDMS,isomer#2 | JsmolCC(C)(C)[Si](C)(C)OC1=C(O[Si](C)(C)C(C)(C)C)[C@@]2(C)CC[C@@H]3C4=CC=C(O)C=C4CC[C@H]3[C@@H]2C1 | TBDMS | 514.3298 | Semi standard non polar | 3287.0981 |
RI00017623 | 16b-Hydroxyestrone,2TBDMS,isomer#3 | JsmolCC(C)(C)[Si](C)(C)OC1=C(O)C[C@H]2[C@@H]3CCC4=CC(O[Si](C)(C)C(C)(C)C)=CC=C4[C@H]3CC[C@]12C | TBDMS | 514.3298 | Semi standard non polar | 3331.4954 |
RI00017624 | 16b-Hydroxyestrone | Jsmol[H][C@@]12C[C@H](O)C(=O)[C@@]1(C)CC[C@]1([H])C3=C(CC[C@@]21[H])C=C(O)C=C3 | Underivatized | 286.1569 | Standard polar | 3438.5525 |
RI00017625 | 16b-Hydroxyestrone,3TMS,isomer#1 | JsmolC[C@]12CC[C@@H]3C4=CC=C(O[Si](C)(C)C)C=C4CC[C@H]3[C@@H]1CC(O[Si](C)(C)C)=C2O[Si](C)(C)C | TMS | 502.2755 | Standard non polar | 2783.1177 |