RI00019426 | 12a-Hydroxy-3-oxocholadienic acid,1TBDMS,isomer#2 | JsmolC[C@H](CCC(=O)O)C1CCC2C3C=CC4=CC(=O)CC[C@]4(C)C3C[C@H](O[Si](C)(C)C(C)(C)C)[C@@]21C | TBDMS | 500.3322 | Semi standard non polar | 3739.7136 |
RI00019427 | 12a-Hydroxy-3-oxocholadienic acid,1TBDMS,isomer#3 | JsmolC[C@H](CCC(=O)O)C1CCC2C3C=CC4=CC(O[Si](C)(C)C(C)(C)C)=CC[C@]4(C)C3C[C@H](O)[C@@]21C | TBDMS | 500.3322 | Semi standard non polar | 3774.329 |
RI00019428 | 12a-Hydroxy-3-oxocholadienic acid,2TBDMS,isomer#1 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C1CCC2C3C=CC4=CC(=O)CC[C@]4(C)C3C[C@H](O[Si](C)(C)C(C)(C)C)[C@@]21C | TBDMS | 614.4187 | Semi standard non polar | 3962.1326 |
RI00019429 | 12a-Hydroxy-3-oxocholadienic acid,2TBDMS,isomer#2 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C1CCC2C3C=CC4=CC(O[Si](C)(C)C(C)(C)C)=CC[C@]4(C)C3C[C@H](O)[C@@]21C | TBDMS | 614.4187 | Semi standard non polar | 3936.0571 |
RI00019430 | 12a-Hydroxy-3-oxocholadienic acid,2TBDMS,isomer#3 | JsmolC[C@H](CCC(=O)O)C1CCC2C3C=CC4=CC(O[Si](C)(C)C(C)(C)C)=CC[C@]4(C)C3C[C@H](O[Si](C)(C)C(C)(C)C)[C@@]21C | TBDMS | 614.4187 | Semi standard non polar | 3937.7612 |
RI00019431 | 12a-Hydroxy-3-oxocholadienic acid | JsmolC[C@H](CCC(O)=O)C1CCC2C3C=CC4=CC(=O)CC[C@]4(C)C3C[C@H](O)[C@]12C | Underivatized | 386.2457 | Standard polar | 4481.4604 |
RI00019432 | 12a-Hydroxy-3-oxocholadienic acid,3TMS,isomer#1 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C)C1CCC2C3C=CC4=CC(O[Si](C)(C)C)=CC[C@]4(C)C3C[C@H](O[Si](C)(C)C)[C@@]21C | TMS | 602.3643 | Standard non polar | 3361.4055 |
RI00019433 | 12a-Hydroxy-3-oxocholadienic acid,3TBDMS,isomer#1 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C1CCC2C3C=CC4=CC(O[Si](C)(C)C(C)(C)C)=CC[C@]4(C)C3C[C@H](O[Si](C)(C)C(C)(C)C)[C@@]21C | TBDMS | 728.5051 | Standard non polar | 4008.9807 |
RI00019434 | 12a-Hydroxy-3-oxocholadienic acid | JsmolC[C@H](CCC(O)=O)C1CCC2C3C=CC4=CC(=O)CC[C@]4(C)C3C[C@H](O)[C@]12C | Underivatized | 386.2457 | Standard non polar | 3111.0977 |
RI00019435 | 12a-Hydroxy-3-oxocholadienic acid | JsmolC[C@H](CCC(O)=O)C1CCC2C3C=CC4=CC(=O)CC[C@]4(C)C3C[C@H](O)[C@]12C | Underivatized | 386.2457 | Semi standard non polar | 3653.357 |
RI00019436 | 12a-Hydroxy-3-oxocholadienic acid,3TMS,isomer#1 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C)C1CCC2C3C=CC4=CC(O[Si](C)(C)C)=CC[C@]4(C)C3C[C@H](O[Si](C)(C)C)[C@@]21C | TMS | 602.3643 | Semi standard non polar | 3393.787 |
RI00019437 | 12a-Hydroxy-3-oxocholadienic acid,3TBDMS,isomer#1 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C1CCC2C3C=CC4=CC(O[Si](C)(C)C(C)(C)C)=CC[C@]4(C)C3C[C@H](O[Si](C)(C)C(C)(C)C)[C@@]21C | TBDMS | 728.5051 | Semi standard non polar | 4044.9883 |
RI00019438 | 12a-Hydroxy-3-oxocholadienic acid,3TMS,isomer#1 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C)C1CCC2C3C=CC4=CC(O[Si](C)(C)C)=CC[C@]4(C)C3C[C@H](O[Si](C)(C)C)[C@@]21C | TMS | 602.3643 | Standard polar | 3747.191 |
RI00019439 | 12a-Hydroxy-3-oxocholadienic acid,3TBDMS,isomer#1 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C1CCC2C3C=CC4=CC(O[Si](C)(C)C(C)(C)C)=CC[C@]4(C)C3C[C@H](O[Si](C)(C)C(C)(C)C)[C@@]21C | TBDMS | 728.5051 | Standard polar | 4014.227 |
RI00019440 | 3-Hydroxydodecanoic acid,1TMS,isomer#1 | JsmolCCCCCCCCC[C@@H](CC(=O)O)O[Si](C)(C)C | TMS | 288.2121 | Semi standard non polar | 1780.9321 |
RI00019441 | 3-Hydroxydodecanoic acid,1TMS,isomer#2 | JsmolCCCCCCCCC[C@H](O)CC(=O)O[Si](C)(C)C | TMS | 288.2121 | Semi standard non polar | 1767.3688 |
RI00019442 | 3-Hydroxydodecanoic acid,2TMS,isomer#1 | JsmolCCCCCCCCC[C@@H](CC(=O)O[Si](C)(C)C)O[Si](C)(C)C | TMS | 360.2516 | Semi standard non polar | 1855.4991 |
RI00019443 | 3-Hydroxydodecanoic acid,1TBDMS,isomer#1 | JsmolCCCCCCCCC[C@@H](CC(=O)O)O[Si](C)(C)C(C)(C)C | TBDMS | 330.259 | Semi standard non polar | 2007.2114 |
RI00019444 | 3-Hydroxydodecanoic acid,1TBDMS,isomer#2 | JsmolCCCCCCCCC[C@H](O)CC(=O)O[Si](C)(C)C(C)(C)C | TBDMS | 330.259 | Semi standard non polar | 2000.8281 |
RI00019445 | 3-Hydroxydodecanoic acid,2TBDMS,isomer#1 | JsmolCCCCCCCCC[C@@H](CC(=O)O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C | TBDMS | 444.3455 | Semi standard non polar | 2314.8667 |
RI00019446 | 3-Hydroxydodecanoic acid | JsmolCCCCCCCCC[C@H](O)CC(O)=O | Underivatized | 216.1725 | Standard polar | 2842.7065 |
RI00019447 | 3-Hydroxydodecanoic acid | JsmolCCCCCCCCC[C@H](O)CC(O)=O | Underivatized | 216.1725 | Standard non polar | 1679.3131 |
RI00019448 | 3-Hydroxydodecanoic acid | JsmolCCCCCCCCC[C@H](O)CC(O)=O | Underivatized | 216.1725 | Semi standard non polar | 1772.5686 |
RI00019449 | 2'-Deoxysepiapterin | JsmolCCC(=O)C1=NC2=C(NC1)NC(N)=NC2=O | Underivatized | 221.0913 | Standard polar | 3309.9312 |
RI00019450 | 2'-Deoxysepiapterin,1TMS,isomer#1 | JsmolCC=C(O[Si](C)(C)C)C1=NC2=C(NC1)[NH]C(N)=NC2=O | TMS | 293.1308 | Standard non polar | 2262.0188 |