RI01713376 | leukotriene-D4,2TMS,isomer#1 | JsmolCCCCCC=CCC=CC=CC=CC(SCC([N+])C(=O)N(CC(=O)[O-])[Si](C)(C)C)C(CCCC(=O)[O-])O[Si](C)(C)C | TMS | 636.309 | Semi standard non polar | 4019.4092 |
RI01713375 | leukotriene-D4,1TMS,isomer#2 | JsmolCCCCCC=CCC=CC=CC=CC(SCC([N+])C(=O)N(CC(=O)[O-])[Si](C)(C)C)C(O)CCCC(=O)[O-] | TMS | 564.2695 | Semi standard non polar | 4011.5964 |
RI01713374 | leukotriene-D4,1TMS,isomer#1 | JsmolCCCCCC=CCC=CC=CC=CC(SCC([N+])C(=O)NCC(=O)[O-])C(CCCC(=O)[O-])O[Si](C)(C)C | TMS | 564.2695 | Semi standard non polar | 3998.916 |
RI01713373 | leukotriene-D4,2TBDMS,isomer#1 | JsmolCCCCCC=CCC=CC=CC=CC(SCC([N+])C(=O)N(CC(=O)[O-])[Si](C)(C)C(C)(C)C)C(CCCC(=O)[O-])O[Si](C)(C)C(C)(C)C | TBDMS | 720.4029 | Standard non polar | 4212.4185 |
RI01713372 | leukotriene-D4,1TBDMS,isomer#2 | JsmolCCCCCC=CCC=CC=CC=CC(SCC([N+])C(=O)N(CC(=O)[O-])[Si](C)(C)C(C)(C)C)C(O)CCCC(=O)[O-] | TBDMS | 606.3164 | Standard non polar | 3984.4097 |
RI01713371 | leukotriene-D4,1TBDMS,isomer#1 | JsmolCCCCCC=CCC=CC=CC=CC(SCC([N+])C(=O)NCC(=O)[O-])C(CCCC(=O)[O-])O[Si](C)(C)C(C)(C)C | TBDMS | 606.3164 | Standard non polar | 3992.4788 |
RI01713370 | leukotriene-D4,2TMS,isomer#1 | JsmolCCCCCC=CCC=CC=CC=CC(SCC([N+])C(=O)N(CC(=O)[O-])[Si](C)(C)C)C(CCCC(=O)[O-])O[Si](C)(C)C | TMS | 636.309 | Standard non polar | 3812.954 |
RI01713369 | leukotriene-D4,1TMS,isomer#2 | JsmolCCCCCC=CCC=CC=CC=CC(SCC([N+])C(=O)N(CC(=O)[O-])[Si](C)(C)C)C(O)CCCC(=O)[O-] | TMS | 564.2695 | Standard non polar | 3778.8877 |
RI01713368 | leukotriene-D4,1TMS,isomer#1 | JsmolCCCCCC=CCC=CC=CC=CC(SCC([N+])C(=O)NCC(=O)[O-])C(CCCC(=O)[O-])O[Si](C)(C)C | TMS | 564.2695 | Standard non polar | 3781.0732 |
RI01713367 | L-alpha-amino-epsilon-keto-pimelate,1TBDMS,isomer#1 | JsmolCC(C)(C)[Si](C)(C)OC(=CCCC([N+])C(=O)[O-])C(=O)[O-] | TBDMS | 299.1194 | Standard polar | 2372.458 |
RI01713366 | L-alpha-amino-epsilon-keto-pimelate,1TMS,isomer#1 | JsmolC[Si](C)(C)OC(=CCCC([N+])C(=O)[O-])C(=O)[O-] | TMS | 257.0725 | Standard polar | 2286.445 |
RI01713365 | L-alpha-amino-epsilon-keto-pimelate,1TBDMS,isomer#1 | JsmolCC(C)(C)[Si](C)(C)OC(=CCCC([N+])C(=O)[O-])C(=O)[O-] | TBDMS | 299.1194 | Semi standard non polar | 1862.446 |
RI01713364 | L-alpha-amino-epsilon-keto-pimelate,1TMS,isomer#1 | JsmolC[Si](C)(C)OC(=CCCC([N+])C(=O)[O-])C(=O)[O-] | TMS | 257.0725 | Semi standard non polar | 1622.8146 |
RI01713363 | L-alpha-amino-epsilon-keto-pimelate,1TBDMS,isomer#1 | JsmolCC(C)(C)[Si](C)(C)OC(=CCCC([N+])C(=O)[O-])C(=O)[O-] | TBDMS | 299.1194 | Standard non polar | 1785.9127 |
RI01713362 | L-alpha-amino-epsilon-keto-pimelate,1TMS,isomer#1 | JsmolC[Si](C)(C)OC(=CCCC([N+])C(=O)[O-])C(=O)[O-] | TMS | 257.0725 | Standard non polar | 1566.0226 |
RI01713361 | L-histidinol-phosphate,5TBDMS,isomer#1 | JsmolCC(C)(C)[Si](C)(C)OP(=O)(OC[C@H](CC1=CN([Si](C)(C)C(C)(C)C)C=N1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C | TBDMS | 791.4889 | Standard polar | 2939.4653 |
RI01713360 | L-histidinol-phosphate,4TBDMS,isomer#3 | JsmolCC(C)(C)[Si](C)(C)OP(=O)(O)OC[C@H](CC1=CN([Si](C)(C)C(C)(C)C)C=N1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C | TBDMS | 677.4025 | Standard polar | 3046.7712 |
RI01713359 | L-histidinol-phosphate,4TBDMS,isomer#2 | JsmolCC(C)(C)[Si](C)(C)N[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)CC1=CN([Si](C)(C)C(C)(C)C)C=N1 | TBDMS | 677.4025 | Standard polar | 2927.7886 |
RI01713358 | L-histidinol-phosphate,4TBDMS,isomer#1 | JsmolCC(C)(C)[Si](C)(C)OP(=O)(OC[C@H](CC1=C[NH]C=N1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C | TBDMS | 677.4025 | Standard polar | 2844.1843 |
RI01713357 | L-histidinol-phosphate,3TBDMS,isomer#5 | JsmolCC(C)(C)[Si](C)(C)N([C@H](COP(=O)(O)O)CC1=CN([Si](C)(C)C(C)(C)C)C=N1)[Si](C)(C)C(C)(C)C | TBDMS | 563.316 | Standard polar | 3336.4226 |
RI01713356 | L-histidinol-phosphate,3TBDMS,isomer#4 | JsmolCC(C)(C)[Si](C)(C)N[C@H](COP(=O)(O)O[Si](C)(C)C(C)(C)C)CC1=CN([Si](C)(C)C(C)(C)C)C=N1 | TBDMS | 563.316 | Standard polar | 3106.3743 |
RI01713355 | L-histidinol-phosphate,3TBDMS,isomer#3 | JsmolCC(C)(C)[Si](C)(C)OP(=O)(O)OC[C@H](CC1=C[NH]C=N1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C | TBDMS | 563.316 | Standard polar | 3054.145 |
RI01713354 | L-histidinol-phosphate,3TBDMS,isomer#2 | JsmolCC(C)(C)[Si](C)(C)OP(=O)(OC[C@@H](N)CC1=CN([Si](C)(C)C(C)(C)C)C=N1)O[Si](C)(C)C(C)(C)C | TBDMS | 563.316 | Standard polar | 3068.9983 |
RI01713353 | L-histidinol-phosphate,3TBDMS,isomer#1 | JsmolCC(C)(C)[Si](C)(C)N[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)CC1=C[NH]C=N1 | TBDMS | 563.316 | Standard polar | 2883.5208 |
RI01713352 | L-histidinol-phosphate,2TBDMS,isomer#5 | JsmolCC(C)(C)[Si](C)(C)N[C@H](COP(=O)(O)O)CC1=CN([Si](C)(C)C(C)(C)C)C=N1 | TBDMS | 449.2295 | Standard polar | 3459.7725 |