RI01723126 | Apiforol sulfate,2TBDMS,isomer#2 | JsmolCC(C)(C)[Si](C)(C)OC1=CC2=C(C(OS(=O)(=O)O)=C1)C(O[Si](C)(C)C(C)(C)C)C[C@@H](C1=CC=C(O)C=C1)O2 | TBDMS | 582.2139 | Standard non polar | 3650.9998 |
RI01723125 | Apiforol sulfate,2TBDMS,isomer#1 | JsmolCC(C)(C)[Si](C)(C)OC1=CC=C([C@@H]2CC(O[Si](C)(C)C(C)(C)C)C3=C(C=C(O)C=C3OS(=O)(=O)O)O2)C=C1 | TBDMS | 582.2139 | Standard non polar | 3681.4739 |
RI01723124 | Apiforol sulfate,1TBDMS,isomer#4 | JsmolCC(C)(C)[Si](C)(C)OS(=O)(=O)OC1=CC(O)=CC2=C1C(O)C[C@@H](C1=CC=C(O)C=C1)O2 | TBDMS | 468.1274 | Standard non polar | 3289.3699 |
RI01723123 | Apiforol sulfate,1TBDMS,isomer#3 | JsmolCC(C)(C)[Si](C)(C)OC1=CC=C([C@@H]2CC(O)C3=C(C=C(O)C=C3OS(=O)(=O)O)O2)C=C1 | TBDMS | 468.1274 | Standard non polar | 3302.538 |
RI01723122 | Apiforol sulfate,1TBDMS,isomer#2 | JsmolCC(C)(C)[Si](C)(C)OC1=CC2=C(C(OS(=O)(=O)O)=C1)C(O)C[C@@H](C1=CC=C(O)C=C1)O2 | TBDMS | 468.1274 | Standard non polar | 3285.1013 |
RI01723121 | Apiforol sulfate,1TBDMS,isomer#1 | JsmolCC(C)(C)[Si](C)(C)OC1C[C@@H](C2=CC=C(O)C=C2)OC2=CC(O)=CC(OS(=O)(=O)O)=C21 | TBDMS | 468.1274 | Standard non polar | 3295.314 |
RI01723120 | Apiforol sulfate,4TMS,isomer#1 | JsmolC[Si](C)(C)OC1=CC=C([C@@H]2CC(O[Si](C)(C)C)C3=C(C=C(O[Si](C)(C)C)C=C3OS(=O)(=O)O[Si](C)(C)C)O2)C=C1 | TMS | 642.199 | Standard non polar | 3299.1567 |
RI01723119 | Apiforol sulfate,3TMS,isomer#4 | JsmolC[Si](C)(C)OC1=CC=C([C@@H]2CC(O)C3=C(C=C(O[Si](C)(C)C)C=C3OS(=O)(=O)O[Si](C)(C)C)O2)C=C1 | TMS | 570.1595 | Standard non polar | 3224.8462 |
RI01723118 | Apiforol sulfate,3TMS,isomer#3 | JsmolC[Si](C)(C)OC1=CC2=C(C(OS(=O)(=O)O[Si](C)(C)C)=C1)C(O[Si](C)(C)C)C[C@@H](C1=CC=C(O)C=C1)O2 | TMS | 570.1595 | Standard non polar | 3233.2485 |
RI01723117 | Apiforol sulfate,3TMS,isomer#2 | JsmolC[Si](C)(C)OC1=CC=C([C@@H]2CC(O[Si](C)(C)C)C3=C(C=C(O)C=C3OS(=O)(=O)O[Si](C)(C)C)O2)C=C1 | TMS | 570.1595 | Standard non polar | 3243.1008 |
RI01723116 | Apiforol sulfate,3TMS,isomer#1 | JsmolC[Si](C)(C)OC1=CC=C([C@@H]2CC(O[Si](C)(C)C)C3=C(C=C(O[Si](C)(C)C)C=C3OS(=O)(=O)O)O2)C=C1 | TMS | 570.1595 | Standard non polar | 3189.514 |
RI01723115 | Apiforol sulfate,2TMS,isomer#6 | JsmolC[Si](C)(C)OC1=CC=C([C@@H]2CC(O)C3=C(C=C(O)C=C3OS(=O)(=O)O[Si](C)(C)C)O2)C=C1 | TMS | 498.12 | Standard non polar | 3146.8342 |
RI01723114 | Apiforol sulfate,2TMS,isomer#5 | JsmolC[Si](C)(C)OC1=CC2=C(C(OS(=O)(=O)O[Si](C)(C)C)=C1)C(O)C[C@@H](C1=CC=C(O)C=C1)O2 | TMS | 498.12 | Standard non polar | 3127.0886 |
RI01723113 | Apiforol sulfate,2TMS,isomer#4 | JsmolC[Si](C)(C)OC1=CC=C([C@@H]2CC(O)C3=C(C=C(O[Si](C)(C)C)C=C3OS(=O)(=O)O)O2)C=C1 | TMS | 498.12 | Standard non polar | 3121.5576 |
RI01723112 | Apiforol sulfate,2TMS,isomer#3 | JsmolC[Si](C)(C)OC1C[C@@H](C2=CC=C(O)C=C2)OC2=CC(O)=CC(OS(=O)(=O)O[Si](C)(C)C)=C21 | TMS | 498.12 | Standard non polar | 3143.7617 |
RI01723111 | Apiforol sulfate,2TMS,isomer#2 | JsmolC[Si](C)(C)OC1=CC2=C(C(OS(=O)(=O)O)=C1)C(O[Si](C)(C)C)C[C@@H](C1=CC=C(O)C=C1)O2 | TMS | 498.12 | Standard non polar | 3121.7158 |
RI01723110 | Apiforol sulfate,2TMS,isomer#1 | JsmolC[Si](C)(C)OC1=CC=C([C@@H]2CC(O[Si](C)(C)C)C3=C(C=C(O)C=C3OS(=O)(=O)O)O2)C=C1 | TMS | 498.12 | Standard non polar | 3130.0056 |
RI01723109 | Apiforol sulfate,1TMS,isomer#4 | JsmolC[Si](C)(C)OS(=O)(=O)OC1=CC(O)=CC2=C1C(O)C[C@@H](C1=CC=C(O)C=C1)O2 | TMS | 426.0805 | Standard non polar | 3024.1675 |
RI01723108 | Apiforol sulfate,1TMS,isomer#3 | JsmolC[Si](C)(C)OC1=CC=C([C@@H]2CC(O)C3=C(C=C(O)C=C3OS(=O)(=O)O)O2)C=C1 | TMS | 426.0805 | Standard non polar | 3042.6582 |
RI01723107 | Apiforol sulfate,1TMS,isomer#2 | JsmolC[Si](C)(C)OC1=CC2=C(C(OS(=O)(=O)O)=C1)C(O)C[C@@H](C1=CC=C(O)C=C1)O2 | TMS | 426.0805 | Standard non polar | 3034.9277 |
RI01723106 | Apiforol sulfate,1TMS,isomer#1 | JsmolC[Si](C)(C)OC1C[C@@H](C2=CC=C(O)C=C2)OC2=CC(O)=CC(OS(=O)(=O)O)=C21 | TMS | 426.0805 | Standard non polar | 3030.327 |
RI01723105 | 3-Hydroxyphenylacetylglutamine sulfate,4TBDMS,isomer#5 | JsmolCC(C)(C)[Si](C)(C)N=C(O[Si](C)(C)C(C)(C)C)[C@H](N=C(O)CC1=CC=CC(OS(=O)(=O)O[Si](C)(C)C(C)(C)C)=C1)C(=O)O[Si](C)(C)C(C)(C)C | TBDMS | 788.3773 | Standard polar | 4023.9768 |
RI01723104 | 3-Hydroxyphenylacetylglutamine sulfate,4TBDMS,isomer#4 | JsmolCC(C)(C)[Si](C)(C)N=C(O)[C@H](N=C(CC1=CC=CC(OS(=O)(=O)O[Si](C)(C)C(C)(C)C)=C1)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C | TBDMS | 788.3773 | Standard polar | 4134.7524 |
RI01723103 | 3-Hydroxyphenylacetylglutamine sulfate,4TBDMS,isomer#3 | JsmolCC(C)(C)[Si](C)(C)N=C(O[Si](C)(C)C(C)(C)C)[C@H](N=C(CC1=CC=CC(OS(=O)(=O)O[Si](C)(C)C(C)(C)C)=C1)O[Si](C)(C)C(C)(C)C)C(=O)O | TBDMS | 788.3773 | Standard polar | 4033.5972 |
RI01723102 | 3-Hydroxyphenylacetylglutamine sulfate,4TBDMS,isomer#2 | JsmolCC(C)(C)[Si](C)(C)N=C(O[Si](C)(C)C(C)(C)C)[C@H](N=C(CC1=CC=CC(OS(=O)(=O)O)=C1)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C | TBDMS | 788.3773 | Standard polar | 3908.8699 |