RI00071801 | 5'-Phosphoribosyl-N-formylglycinamide,5TBDMS,isomer#2 | JsmolCC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)O[C@@H](NC(=O)CN(C=O)[Si](C)(C)C(C)(C)C)[C@@H]1O[Si](C)(C)C(C)(C)C | TBDMS | 884.4839 | Standard polar | 3499.6064 |
RI00071802 | 5'-Phosphoribosyl-N-formylglycinamide,5TBDMS,isomer#3 | JsmolCC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)O[Si](C)(C)C(C)(C)C)O[C@@H](N(C(=O)CN(C=O)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[C@@H]1O[Si](C)(C)C(C)(C)C | TBDMS | 884.4839 | Standard polar | 3580.5388 |
RI00071803 | 5'-Phosphoribosyl-N-formylglycinamide,5TBDMS,isomer#4 | JsmolCC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)O[C@@H](N(C(=O)CN(C=O)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[C@@H]1O | TBDMS | 884.4839 | Standard polar | 3491.8057 |
RI00071804 | 5'-Phosphoribosyl-N-formylglycinamide,5TBDMS,isomer#5 | JsmolCC(C)(C)[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)O[C@H]1N(C(=O)CN(C=O)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C | TBDMS | 884.4839 | Standard polar | 3507.3743 |
RI00071805 | m-Chlorohippuric acid,1TMS,isomer#1 | JsmolC[Si](C)(C)OC(=O)CNC(=O)C1=CC=CC(Cl)=C1 | TMS | 285.0588 | Semi standard non polar | 2012.2366 |
RI00071806 | m-Chlorohippuric acid,1TMS,isomer#2 | JsmolC[Si](C)(C)N(CC(=O)O)C(=O)C1=CC=CC(Cl)=C1 | TMS | 285.0588 | Semi standard non polar | 1955.0723 |
RI00071807 | m-Chlorohippuric acid,1TBDMS,isomer#1 | JsmolCC(C)(C)[Si](C)(C)OC(=O)CNC(=O)C1=CC=CC(Cl)=C1 | TBDMS | 327.1057 | Semi standard non polar | 2261.4658 |
RI00071808 | m-Chlorohippuric acid,1TBDMS,isomer#2 | JsmolCC(C)(C)[Si](C)(C)N(CC(=O)O)C(=O)C1=CC=CC(Cl)=C1 | TBDMS | 327.1057 | Semi standard non polar | 2211.9146 |
RI00071809 | m-Chlorohippuric acid | JsmolOC(=O)CNC(=O)C1=CC(Cl)=CC=C1 | Underivatized | 213.0193 | Standard polar | 2935.1448 |
RI00071810 | m-Chlorohippuric acid,2TMS,isomer#1 | JsmolC[Si](C)(C)OC(=O)CN(C(=O)C1=CC=CC(Cl)=C1)[Si](C)(C)C | TMS | 357.0983 | Standard non polar | 1976.4242 |
RI00071811 | m-Chlorohippuric acid,2TBDMS,isomer#1 | JsmolCC(C)(C)[Si](C)(C)OC(=O)CN(C(=O)C1=CC=CC(Cl)=C1)[Si](C)(C)C(C)(C)C | TBDMS | 441.1922 | Standard non polar | 2388.2705 |
RI00071812 | m-Chlorohippuric acid | JsmolOC(=O)CNC(=O)C1=CC(Cl)=CC=C1 | Underivatized | 213.0193 | Standard non polar | 1771.2399 |
RI00071813 | m-Chlorohippuric acid | JsmolOC(=O)CNC(=O)C1=CC(Cl)=CC=C1 | Underivatized | 213.0193 | Semi standard non polar | 2000.463 |
RI00071814 | m-Chlorohippuric acid,2TMS,isomer#1 | JsmolC[Si](C)(C)OC(=O)CN(C(=O)C1=CC=CC(Cl)=C1)[Si](C)(C)C | TMS | 357.0983 | Semi standard non polar | 1975.6615 |
RI00071815 | m-Chlorohippuric acid,2TBDMS,isomer#1 | JsmolCC(C)(C)[Si](C)(C)OC(=O)CN(C(=O)C1=CC=CC(Cl)=C1)[Si](C)(C)C(C)(C)C | TBDMS | 441.1922 | Semi standard non polar | 2447.6003 |
RI00071816 | m-Chlorohippuric acid,2TMS,isomer#1 | JsmolC[Si](C)(C)OC(=O)CN(C(=O)C1=CC=CC(Cl)=C1)[Si](C)(C)C | TMS | 357.0983 | Standard polar | 2277.933 |
RI00071817 | m-Chlorohippuric acid,2TBDMS,isomer#1 | JsmolCC(C)(C)[Si](C)(C)OC(=O)CN(C(=O)C1=CC=CC(Cl)=C1)[Si](C)(C)C(C)(C)C | TBDMS | 441.1922 | Standard polar | 2500.3162 |
RI00071818 | D-Alanine,1TMS,isomer#1 | JsmolC[C@@H](N)C(=O)O[Si](C)(C)C | TMS | 161.0872 | Semi standard non polar | 944.7369 |
RI00071819 | D-Alanine,1TMS,isomer#2 | JsmolC[C@@H](N[Si](C)(C)C)C(=O)O | TMS | 161.0872 | Semi standard non polar | 1060.9442 |
RI00071820 | D-Alanine,1TBDMS,isomer#1 | JsmolC[C@@H](N)C(=O)O[Si](C)(C)C(C)(C)C | TBDMS | 203.1342 | Semi standard non polar | 1167.5343 |
RI00071821 | D-Alanine,1TBDMS,isomer#2 | JsmolC[C@@H](N[Si](C)(C)C(C)(C)C)C(=O)O | TBDMS | 203.1342 | Semi standard non polar | 1337.0369 |
RI00071822 | D-Alanine | JsmolC[C@@H](N)C(O)=O | Underivatized | 89.0477 | Standard polar | 1700.3242 |
RI00071823 | D-Alanine,2TMS,isomer#1 | JsmolC[C@@H](N[Si](C)(C)C)C(=O)O[Si](C)(C)C | TMS | 233.1267 | Standard non polar | 1130.9713 |
RI00071824 | D-Alanine,2TMS,isomer#2 | JsmolC[C@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C | TMS | 233.1267 | Standard non polar | 1153.1224 |
RI00071825 | D-Alanine,3TMS,isomer#1 | JsmolC[C@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C | TMS | 305.1663 | Standard non polar | 1248.3502 |