| RI01714126 | pppGpp,2TMS,isomer#6 | JsmolC[Si](C)(C)N(C1=NC2=C(N=CN2C2OC(COP(=O)([O-])OP(=O)([O-])OP(=O)([O-])[O-])C(OP(=O)([O-])OP(=O)([O-])O)C2O)C(=O)[NH]1)[Si](C)(C)C | TMS | 820.9587 | Standard non polar | 4592.859 |
| RI01714125 | pppGpp,2TMS,isomer#5 | JsmolC[Si](C)(C)OP(=O)([O-])OP(=O)([O-])OC1C(COP(=O)([O-])OP(=O)([O-])OP(=O)([O-])[O-])OC(N2C=NC3=C2N=C(N)N([Si](C)(C)C)C3=O)C1O | TMS | 820.9587 | Standard non polar | 4511.964 |
| RI01714124 | pppGpp,2TMS,isomer#4 | JsmolC[Si](C)(C)NC1=NC2=C(N=CN2C2OC(COP(=O)([O-])OP(=O)([O-])OP(=O)([O-])[O-])C(OP(=O)([O-])OP(=O)([O-])O[Si](C)(C)C)C2O)C(=O)[NH]1 | TMS | 820.9587 | Standard non polar | 4520.103 |
| RI01714123 | pppGpp,2TMS,isomer#3 | JsmolC[Si](C)(C)OC1C(OP(=O)([O-])OP(=O)([O-])O)C(COP(=O)([O-])OP(=O)([O-])OP(=O)([O-])[O-])OC1N1C=NC2=C1N=C(N)N([Si](C)(C)C)C2=O | TMS | 820.9587 | Standard non polar | 4373.4634 |
| RI01714122 | pppGpp,2TMS,isomer#2 | JsmolC[Si](C)(C)NC1=NC2=C(N=CN2C2OC(COP(=O)([O-])OP(=O)([O-])OP(=O)([O-])[O-])C(OP(=O)([O-])OP(=O)([O-])O)C2O[Si](C)(C)C)C(=O)[NH]1 | TMS | 820.9587 | Standard non polar | 4371.357 |
| RI01714121 | pppGpp,2TMS,isomer#1 | JsmolC[Si](C)(C)OC1C(OP(=O)([O-])OP(=O)([O-])O[Si](C)(C)C)C(COP(=O)([O-])OP(=O)([O-])OP(=O)([O-])[O-])OC1N1C=NC2=C1N=C(N)[NH]C2=O | TMS | 820.9587 | Standard non polar | 4366.1436 |
| RI01714120 | ppGpp,2TBDMS,isomer#7 | JsmolCC(C)(C)[Si](C)(C)NC1=NC2=C(N=CN2C2OC(COP(=O)([O-])OP(=O)([O-])O)C(OP(=O)([O-])OP(=O)([O-])[O-])C2O)C(=O)N1[Si](C)(C)C(C)(C)C | TBDMS | 826.0936 | Standard polar | 6057.3154 |
| RI01714119 | ppGpp,2TBDMS,isomer#6 | JsmolCC(C)(C)[Si](C)(C)N(C1=NC2=C(N=CN2C2OC(COP(=O)([O-])OP(=O)([O-])O)C(OP(=O)([O-])OP(=O)([O-])[O-])C2O)C(=O)[NH]1)[Si](C)(C)C(C)(C)C | TBDMS | 826.0936 | Standard polar | 5986.2266 |
| RI01714118 | ppGpp,2TBDMS,isomer#5 | JsmolCC(C)(C)[Si](C)(C)OP(=O)([O-])OP(=O)([O-])OCC1OC(N2C=NC3=C2N=C(N)N([Si](C)(C)C(C)(C)C)C3=O)C(O)C1OP(=O)([O-])OP(=O)([O-])[O-] | TBDMS | 826.0936 | Standard polar | 6376.3813 |
| RI01714117 | ppGpp,2TBDMS,isomer#4 | JsmolCC(C)(C)[Si](C)(C)NC1=NC2=C(N=CN2C2OC(COP(=O)([O-])OP(=O)([O-])O[Si](C)(C)C(C)(C)C)C(OP(=O)([O-])OP(=O)([O-])[O-])C2O)C(=O)[NH]1 | TBDMS | 826.0936 | Standard polar | 6008.179 |
| RI01714116 | ppGpp,2TBDMS,isomer#3 | JsmolCC(C)(C)[Si](C)(C)OC1C(OP(=O)([O-])OP(=O)([O-])[O-])C(COP(=O)([O-])OP(=O)([O-])O)OC1N1C=NC2=C1N=C(N)N([Si](C)(C)C(C)(C)C)C2=O | TBDMS | 826.0936 | Standard polar | 6437.886 |
| RI01714115 | ppGpp,2TBDMS,isomer#2 | JsmolCC(C)(C)[Si](C)(C)NC1=NC2=C(N=CN2C2OC(COP(=O)([O-])OP(=O)([O-])O)C(OP(=O)([O-])OP(=O)([O-])[O-])C2O[Si](C)(C)C(C)(C)C)C(=O)[NH]1 | TBDMS | 826.0936 | Standard polar | 6042.8613 |
| RI01714114 | ppGpp,2TBDMS,isomer#1 | JsmolCC(C)(C)[Si](C)(C)OC1C(OP(=O)([O-])OP(=O)([O-])[O-])C(COP(=O)([O-])OP(=O)([O-])O[Si](C)(C)C(C)(C)C)OC1N1C=NC2=C1N=C(N)[NH]C2=O | TBDMS | 826.0936 | Standard polar | 6198.605 |
| RI01714113 | ppGpp,4TMS,isomer#4 | JsmolC[Si](C)(C)OP(=O)([O-])OP(=O)([O-])OCC1OC(N2C=NC3=C2N=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)C3=O)C(O)C1OP(=O)([O-])OP(=O)([O-])[O-] | TMS | 886.0787 | Standard polar | 5442.239 |
| RI01714112 | ppGpp,4TMS,isomer#3 | JsmolC[Si](C)(C)OC1C(OP(=O)([O-])OP(=O)([O-])[O-])C(COP(=O)([O-])OP(=O)([O-])O)OC1N1C=NC2=C1N=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)C2=O | TMS | 886.0787 | Standard polar | 5500.2183 |
| RI01714111 | ppGpp,4TMS,isomer#2 | JsmolC[Si](C)(C)NC1=NC2=C(N=CN2C2OC(COP(=O)([O-])OP(=O)([O-])O[Si](C)(C)C)C(OP(=O)([O-])OP(=O)([O-])[O-])C2O[Si](C)(C)C)C(=O)N1[Si](C)(C)C | TMS | 886.0787 | Standard polar | 5448.9688 |
| RI01714110 | ppGpp,4TMS,isomer#1 | JsmolC[Si](C)(C)OC1C(OP(=O)([O-])OP(=O)([O-])[O-])C(COP(=O)([O-])OP(=O)([O-])O[Si](C)(C)C)OC1N1C=NC2=C1N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C2=O | TMS | 886.0787 | Standard polar | 5375.513 |
| RI01714109 | ppGpp,3TMS,isomer#7 | JsmolC[Si](C)(C)N(C1=NC2=C(N=CN2C2OC(COP(=O)([O-])OP(=O)([O-])O)C(OP(=O)([O-])OP(=O)([O-])[O-])C2O)C(=O)N1[Si](C)(C)C)[Si](C)(C)C | TMS | 814.0392 | Standard polar | 5804.1626 |
| RI01714108 | ppGpp,3TMS,isomer#6 | JsmolC[Si](C)(C)NC1=NC2=C(N=CN2C2OC(COP(=O)([O-])OP(=O)([O-])O[Si](C)(C)C)C(OP(=O)([O-])OP(=O)([O-])[O-])C2O)C(=O)N1[Si](C)(C)C | TMS | 814.0392 | Standard polar | 5732.9624 |
| RI01714107 | ppGpp,3TMS,isomer#5 | JsmolC[Si](C)(C)OP(=O)([O-])OP(=O)([O-])OCC1OC(N2C=NC3=C2N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)C(O)C1OP(=O)([O-])OP(=O)([O-])[O-] | TMS | 814.0392 | Standard polar | 5657.826 |
| RI01714106 | ppGpp,3TMS,isomer#4 | JsmolC[Si](C)(C)NC1=NC2=C(N=CN2C2OC(COP(=O)([O-])OP(=O)([O-])O)C(OP(=O)([O-])OP(=O)([O-])[O-])C2O[Si](C)(C)C)C(=O)N1[Si](C)(C)C | TMS | 814.0392 | Standard polar | 5796.7417 |
| RI01714105 | ppGpp,3TMS,isomer#3 | JsmolC[Si](C)(C)OC1C(OP(=O)([O-])OP(=O)([O-])[O-])C(COP(=O)([O-])OP(=O)([O-])O)OC1N1C=NC2=C1N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C2=O | TMS | 814.0392 | Standard polar | 5720.8525 |
| RI01714104 | ppGpp,3TMS,isomer#2 | JsmolC[Si](C)(C)OC1C(OP(=O)([O-])OP(=O)([O-])[O-])C(COP(=O)([O-])OP(=O)([O-])O[Si](C)(C)C)OC1N1C=NC2=C1N=C(N)N([Si](C)(C)C)C2=O | TMS | 814.0392 | Standard polar | 6133.238 |
| RI01714103 | ppGpp,3TMS,isomer#1 | JsmolC[Si](C)(C)NC1=NC2=C(N=CN2C2OC(COP(=O)([O-])OP(=O)([O-])O[Si](C)(C)C)C(OP(=O)([O-])OP(=O)([O-])[O-])C2O[Si](C)(C)C)C(=O)[NH]1 | TMS | 814.0392 | Standard polar | 5679.2866 |
| RI01714102 | ppGpp,2TMS,isomer#7 | JsmolC[Si](C)(C)NC1=NC2=C(N=CN2C2OC(COP(=O)([O-])OP(=O)([O-])O)C(OP(=O)([O-])OP(=O)([O-])[O-])C2O)C(=O)N1[Si](C)(C)C | TMS | 741.9997 | Standard polar | 6169.3306 |