RI01713401 | N-acetylglutamyl-phosphate,2TBDMS,isomer#1 | JsmolCC([O-])=NC(CCC(=O)[O-])C(=O)OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C | TBDMS | 495.1885 | Standard non polar | 2478.2744 |
RI01713400 | N-acetylglutamyl-phosphate,1TBDMS,isomer#1 | JsmolCC([O-])=NC(CCC(=O)[O-])C(=O)OP(=O)(O)O[Si](C)(C)C(C)(C)C | TBDMS | 381.102 | Standard non polar | 2172.937 |
RI01713399 | N-acetylglutamyl-phosphate,2TMS,isomer#1 | JsmolCC([O-])=NC(CCC(=O)[O-])C(=O)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C | TMS | 411.0946 | Standard non polar | 2053.4192 |
RI01713398 | N-acetylglutamyl-phosphate,1TMS,isomer#1 | JsmolCC([O-])=NC(CCC(=O)[O-])C(=O)OP(=O)(O)O[Si](C)(C)C | TMS | 339.055 | Standard non polar | 1937.3245 |
RI01713397 | N,N-dihydroxy-L-tryptophan,1TBDMS,isomer#1 | JsmolCC(C)(C)[Si](C)(C)N1C=C(CC(C(=O)[O-])N(O)O)C2=CC=CC=C21 | TBDMS | 349.1589 | Standard polar | 3233.5093 |
RI01713396 | N,N-dihydroxy-L-tryptophan,1TMS,isomer#1 | JsmolC[Si](C)(C)N1C=C(CC(C(=O)[O-])N(O)O)C2=CC=CC=C21 | TMS | 307.112 | Standard polar | 3238.4756 |
RI01713395 | N,N-dihydroxy-L-tryptophan,1TBDMS,isomer#1 | JsmolCC(C)(C)[Si](C)(C)N1C=C(CC(C(=O)[O-])N(O)O)C2=CC=CC=C21 | TBDMS | 349.1589 | Semi standard non polar | 2535.513 |
RI01713394 | N,N-dihydroxy-L-tryptophan,1TMS,isomer#1 | JsmolC[Si](C)(C)N1C=C(CC(C(=O)[O-])N(O)O)C2=CC=CC=C21 | TMS | 307.112 | Semi standard non polar | 2262.1777 |
RI01713393 | N,N-dihydroxy-L-tryptophan,1TBDMS,isomer#1 | JsmolCC(C)(C)[Si](C)(C)N1C=C(CC(C(=O)[O-])N(O)O)C2=CC=CC=C21 | TBDMS | 349.1589 | Standard non polar | 2524.2983 |
RI01713392 | N,N-dihydroxy-L-tryptophan,1TMS,isomer#1 | JsmolC[Si](C)(C)N1C=C(CC(C(=O)[O-])N(O)O)C2=CC=CC=C21 | TMS | 307.112 | Standard non polar | 2334.3723 |
RI01713391 | marneral,1TBDMS,isomer#1 | JsmolCC(C)=CCCC(C)=CCCC(C)=CCCC1(C)C(C)CCC(=C(C)C)C1CC=CO[Si](C)(C)C(C)(C)C | TBDMS | 540.4726 | Standard polar | 3253.453 |
RI01713390 | marneral,1TMS,isomer#1 | JsmolCC(C)=CCCC(C)=CCCC(C)=CCCC1(C)C(C)CCC(=C(C)C)C1CC=CO[Si](C)(C)C | TMS | 498.4257 | Standard polar | 3165.8032 |
RI01713389 | marneral,1TBDMS,isomer#1 | JsmolCC(C)=CCCC(C)=CCCC(C)=CCCC1(C)C(C)CCC(=C(C)C)C1CC=CO[Si](C)(C)C(C)(C)C | TBDMS | 540.4726 | Semi standard non polar | 3402.6042 |
RI01713388 | marneral,1TMS,isomer#1 | JsmolCC(C)=CCCC(C)=CCCC(C)=CCCC1(C)C(C)CCC(=C(C)C)C1CC=CO[Si](C)(C)C | TMS | 498.4257 | Semi standard non polar | 3167.2708 |
RI01713387 | marneral,1TBDMS,isomer#1 | JsmolCC(C)=CCCC(C)=CCCC(C)=CCCC1(C)C(C)CCC(=C(C)C)C1CC=CO[Si](C)(C)C(C)(C)C | TBDMS | 540.4726 | Standard non polar | 3277.6875 |
RI01713386 | marneral,1TMS,isomer#1 | JsmolCC(C)=CCCC(C)=CCCC(C)=CCCC1(C)C(C)CCC(=C(C)C)C1CC=CO[Si](C)(C)C | TMS | 498.4257 | Standard non polar | 3109.5867 |
RI01713385 | 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 polar | 4605.281 |
RI01713384 | 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 polar | 4860.714 |
RI01713383 | 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 polar | 4888.087 |
RI01713382 | 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 polar | 4550.8076 |
RI01713381 | 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 polar | 4848.05 |
RI01713380 | 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 polar | 4885.9937 |
RI01713379 | 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 | Semi standard non polar | 4476.5864 |
RI01713378 | 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 | Semi standard non polar | 4238.163 |
RI01713377 | 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 | Semi standard non polar | 4227.1245 |