RI00000226 | Deoxycorticosterone,1TMS,isomer#1 | JsmolC[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@@]43C)[C@@H]1CC[C@@H]2C(=O)CO[Si](C)(C)C | TMS | 402.259 | Semi standard non polar | 3162.3997 |
RI00000227 | Deoxycorticosterone,1TMS,isomer#2 | JsmolC[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@@]43C)[C@@H]1CCC2=C(CO)O[Si](C)(C)C | TMS | 402.259 | Semi standard non polar | 3098.1843 |
RI00000228 | Deoxycorticosterone,1TMS,isomer#3 | JsmolC[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@@]43C)[C@@H]1CC[C@@H]2C(=CO)O[Si](C)(C)C | TMS | 402.259 | Semi standard non polar | 3107.1309 |
RI00000229 | Deoxycorticosterone,1TMS,isomer#4 | JsmolC[C@]12CC[C@H]3[C@@H](CCC4=CC(O[Si](C)(C)C)=CC[C@@]43C)[C@@H]1CC[C@@H]2C(=O)CO | TMS | 402.259 | Semi standard non polar | 3044.9802 |
RI00000230 | Deoxycorticosterone,1TBDMS,isomer#1 | JsmolCC(C)(C)[Si](C)(C)OCC(=O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C | TBDMS | 444.306 | Semi standard non polar | 3429.5967 |
RI00000231 | Deoxycorticosterone,1TBDMS,isomer#2 | JsmolCC(C)(C)[Si](C)(C)OC(CO)=C1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C | TBDMS | 444.306 | Semi standard non polar | 3375.3423 |
RI00000232 | Deoxycorticosterone,1TBDMS,isomer#3 | JsmolCC(C)(C)[Si](C)(C)OC(=CO)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C | TBDMS | 444.306 | Semi standard non polar | 3347.3076 |
RI00000233 | Deoxycorticosterone,1TBDMS,isomer#4 | JsmolCC(C)(C)[Si](C)(C)OC1=CC[C@@]2(C)C(=C1)CC[C@H]1[C@@H]3CC[C@H](C(=O)CO)[C@@]3(C)CC[C@@H]12 | TBDMS | 444.306 | Semi standard non polar | 3317.3804 |
RI00000234 | Deoxycorticosterone | Jsmol[H][C@@]12CC[C@H](C(=O)CO)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CCC2=CC(=O)CC[C@]12C | Underivatized | 330.2195 | Standard polar | 3169.1367 |
RI00000235 | Deoxycorticosterone,2TMS,isomer#1 | JsmolC[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@@]43C)[C@@H]1CCC2=C(CO[Si](C)(C)C)O[Si](C)(C)C | TMS | 474.2985 | Standard non polar | 3006.939 |
RI00000236 | Deoxycorticosterone,2TMS,isomer#2 | JsmolC[C@]12CC[C@H]3[C@@H](CCC4=CC(O[Si](C)(C)C)=CC[C@@]43C)[C@@H]1CC[C@@H]2C(=O)CO[Si](C)(C)C | TMS | 474.2985 | Standard non polar | 3036.9636 |
RI00000237 | Deoxycorticosterone,2TMS,isomer#3 | JsmolC[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@@]43C)[C@@H]1CC[C@@H]2C(=CO[Si](C)(C)C)O[Si](C)(C)C | TMS | 474.2985 | Standard non polar | 2968.129 |
RI00000238 | Deoxycorticosterone,2TMS,isomer#4 | JsmolC[C@]12CC[C@H]3[C@@H](CCC4=CC(O[Si](C)(C)C)=CC[C@@]43C)[C@@H]1CCC2=C(CO)O[Si](C)(C)C | TMS | 474.2985 | Standard non polar | 2977.1582 |
RI00000239 | Deoxycorticosterone,2TMS,isomer#5 | JsmolC[C@]12CC[C@H]3[C@@H](CCC4=CC(O[Si](C)(C)C)=CC[C@@]43C)[C@@H]1CC[C@@H]2C(=CO)O[Si](C)(C)C | TMS | 474.2985 | Standard non polar | 2948.2937 |
RI00000240 | Deoxycorticosterone,3TMS,isomer#1 | JsmolC[C@]12CC[C@H]3[C@@H](CCC4=CC(O[Si](C)(C)C)=CC[C@@]43C)[C@@H]1CCC2=C(CO[Si](C)(C)C)O[Si](C)(C)C | TMS | 546.3381 | Standard non polar | 3097.1174 |
RI00000241 | Deoxycorticosterone,3TMS,isomer#2 | JsmolC[C@]12CC[C@H]3[C@@H](CCC4=CC(O[Si](C)(C)C)=CC[C@@]43C)[C@@H]1CC[C@@H]2C(=CO[Si](C)(C)C)O[Si](C)(C)C | TMS | 546.3381 | Standard non polar | 3052.3784 |
RI00000242 | Deoxycorticosterone,2TBDMS,isomer#1 | JsmolCC(C)(C)[Si](C)(C)OCC(O[Si](C)(C)C(C)(C)C)=C1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C | TBDMS | 558.3924 | Standard non polar | 3515.0706 |
RI00000243 | Deoxycorticosterone,2TBDMS,isomer#2 | JsmolCC(C)(C)[Si](C)(C)OC=C(O[Si](C)(C)C(C)(C)C)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C | TBDMS | 558.3924 | Standard non polar | 3461.1245 |
RI00000244 | Deoxycorticosterone,2TBDMS,isomer#3 | JsmolCC(C)(C)[Si](C)(C)OCC(=O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(O[Si](C)(C)C(C)(C)C)=CC[C@]4(C)[C@H]3CC[C@]12C | TBDMS | 558.3924 | Standard non polar | 3488.7832 |
RI00000245 | Deoxycorticosterone,2TBDMS,isomer#4 | JsmolCC(C)(C)[Si](C)(C)OC1=CC[C@@]2(C)C(=C1)CC[C@H]1[C@@H]3CCC(=C(CO)O[Si](C)(C)C(C)(C)C)[C@@]3(C)CC[C@@H]12 | TBDMS | 558.3924 | Standard non polar | 3417.6028 |
RI00000246 | Deoxycorticosterone,2TBDMS,isomer#5 | JsmolCC(C)(C)[Si](C)(C)OC1=CC[C@@]2(C)C(=C1)CC[C@H]1[C@@H]3CC[C@H](C(=CO)O[Si](C)(C)C(C)(C)C)[C@@]3(C)CC[C@@H]12 | TBDMS | 558.3924 | Standard non polar | 3395.6401 |
RI00000247 | Deoxycorticosterone,3TBDMS,isomer#1 | JsmolCC(C)(C)[Si](C)(C)OCC(O[Si](C)(C)C(C)(C)C)=C1CC[C@H]2[C@@H]3CCC4=CC(O[Si](C)(C)C(C)(C)C)=CC[C@]4(C)[C@H]3CC[C@]12C | TBDMS | 672.4789 | Standard non polar | 3737.46 |
RI00000248 | Deoxycorticosterone,3TBDMS,isomer#2 | JsmolCC(C)(C)[Si](C)(C)OC=C(O[Si](C)(C)C(C)(C)C)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(O[Si](C)(C)C(C)(C)C)=CC[C@]4(C)[C@H]3CC[C@]12C | TBDMS | 672.4789 | Standard non polar | 3662.0503 |
RI00000249 | Deoxycorticosterone | Jsmol[H][C@@]12CC[C@H](C(=O)CO)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CCC2=CC(=O)CC[C@]12C | Underivatized | 330.2195 | Standard non polar | 2862.8923 |
RI00000250 | Deoxycorticosterone | Jsmol[H][C@@]12CC[C@H](C(=O)CO)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CCC2=CC(=O)CC[C@]12C | Underivatized | 330.2195 | Semi standard non polar | 3113.2568 |