RI00003076 | Bilirubin,3TMS,isomer#8 | JsmolC=CC1=C(C)/C(=C/C2=C(C)C(CCC(=O)O)=C(CC3=C(CCC(=O)O[Si](C)(C)C)C(C)=C(/C=C4/C(C=C)=C(C)C(=O)N4[Si](C)(C)C)N3[Si](C)(C)C)[NH]2)NC1=O | TMS | 800.3821 | Semi standard non polar | 4968.9043 |
RI00003077 | Bilirubin,3TMS,isomer#9 | JsmolC=CC1=C(C)/C(=C/C2=C(C)C(CCC(=O)O)=C(CC3=C(CCC(=O)O[Si](C)(C)C)C(C)=C(/C=C4\NC(=O)C(C)=C4C=C)N3[Si](C)(C)C)[NH]2)N([Si](C)(C)C)C1=O | TMS | 800.3821 | Semi standard non polar | 4942.327 |
RI00003078 | Bilirubin,3TMS,isomer#10 | JsmolC=CC1=C(C)/C(=C/C2=C(C)C(CCC(=O)O)=C(CC3=C(CCC(=O)O[Si](C)(C)C)C(C)=C(/C=C4/C(C=C)=C(C)C(=O)N4[Si](C)(C)C)[NH]3)[NH]2)N([Si](C)(C)C)C1=O | TMS | 800.3821 | Semi standard non polar | 4754.132 |
RI00003079 | Bilirubin,3TMS,isomer#11 | JsmolC=CC1=C(C)/C(=C/C2=C(C)C(CCC(=O)O[Si](C)(C)C)=C(CC3=C(CCC(=O)O)C(C)=C(/C=C4\NC(=O)C(C)=C4C=C)N3[Si](C)(C)C)N2[Si](C)(C)C)NC1=O | TMS | 800.3821 | Semi standard non polar | 5142.688 |
RI00003080 | Bilirubin,3TMS,isomer#12 | JsmolC=CC1=C(C)/C(=C/C2=C(C)C(CCC(=O)O[Si](C)(C)C)=C(CC3=C(CCC(=O)O)C(C)=C(/C=C4/C(C=C)=C(C)C(=O)N4[Si](C)(C)C)[NH]3)N2[Si](C)(C)C)NC1=O | TMS | 800.3821 | Semi standard non polar | 4956.6475 |
RI00003081 | Bilirubin,3TMS,isomer#13 | JsmolC=CC1=C(C)/C(=C/C2=C(C)C(CCC(=O)O[Si](C)(C)C)=C(CC3=C(CCC(=O)O)C(C)=C(/C=C4\NC(=O)C(C)=C4C=C)[NH]3)N2[Si](C)(C)C)N([Si](C)(C)C)C1=O | TMS | 800.3821 | Semi standard non polar | 4954.1304 |
RI00003082 | Bilirubin,3TMS,isomer#14 | JsmolC=CC1=C(C)/C(=C/C2=C(C)C(CCC(=O)O[Si](C)(C)C)=C(CC3=C(CCC(=O)O)C(C)=C(/C=C4/C(C=C)=C(C)C(=O)N4[Si](C)(C)C)N3[Si](C)(C)C)[NH]2)NC1=O | TMS | 800.3821 | Semi standard non polar | 4967.845 |
RI00003083 | Bilirubin,3TMS,isomer#15 | JsmolC=CC1=C(C)/C(=C/C2=C(C)C(CCC(=O)O[Si](C)(C)C)=C(CC3=C(CCC(=O)O)C(C)=C(/C=C4\NC(=O)C(C)=C4C=C)N3[Si](C)(C)C)[NH]2)N([Si](C)(C)C)C1=O | TMS | 800.3821 | Semi standard non polar | 4941.623 |
RI00003084 | Bilirubin,3TMS,isomer#16 | JsmolC=CC1=C(C)/C(=C/C2=C(C)C(CCC(=O)O[Si](C)(C)C)=C(CC3=C(CCC(=O)O)C(C)=C(/C=C4/C(C=C)=C(C)C(=O)N4[Si](C)(C)C)[NH]3)[NH]2)N([Si](C)(C)C)C1=O | TMS | 800.3821 | Semi standard non polar | 4754.174 |
RI00003085 | Bilirubin,3TMS,isomer#17 | JsmolC=CC1=C(C)/C(=C/C2=C(C)C(CCC(=O)O)=C(CC3=C(CCC(=O)O)C(C)=C(/C=C4/C(C=C)=C(C)C(=O)N4[Si](C)(C)C)N3[Si](C)(C)C)N2[Si](C)(C)C)NC1=O | TMS | 800.3821 | Semi standard non polar | 5070.9297 |
RI00003086 | Bilirubin,3TMS,isomer#18 | JsmolC=CC1=C(C)/C(=C/C2=C(C)C(CCC(=O)O)=C(CC3=C(CCC(=O)O)C(C)=C(/C=C4/C(C=C)=C(C)C(=O)N4[Si](C)(C)C)[NH]3)N2[Si](C)(C)C)N([Si](C)(C)C)C1=O | TMS | 800.3821 | Semi standard non polar | 4858.7817 |
RI00003087 | Bilirubin,3TMS,isomer#19 | JsmolC=CC1=C(C)/C(=C/C2=C(C)C(CCC(=O)O)=C(CC3=C(CCC(=O)O)C(C)=C(/C=C4/C(C=C)=C(C)C(=O)N4[Si](C)(C)C)N3[Si](C)(C)C)[NH]2)N([Si](C)(C)C)C1=O | TMS | 800.3821 | Semi standard non polar | 4855.5723 |
RI00003088 | Bilirubin,3TMS,isomer#20 | JsmolC=CC1=C(C)/C(=C/C2=C(C)C(CCC(=O)O)=C(CC3=C(CCC(=O)O)C(C)=C(/C=C4\NC(=O)C(C)=C4C=C)N3[Si](C)(C)C)N2[Si](C)(C)C)N([Si](C)(C)C)C1=O | TMS | 800.3821 | Semi standard non polar | 5067.5903 |
RI00003089 | Bilirubin,4TMS,isomer#1 | JsmolC=CC1=C(C)/C(=C/C2=C(C)C(CCC(=O)O[Si](C)(C)C)=C(CC3=C(CCC(=O)O[Si](C)(C)C)C(C)=C(/C=C4\NC(=O)C(C)=C4C=C)N3[Si](C)(C)C)N2[Si](C)(C)C)NC1=O | TMS | 872.4216 | Semi standard non polar | 4983.712 |
RI00003090 | Bilirubin,4TMS,isomer#2 | JsmolC=CC1=C(C)/C(=C/C2=C(C)C(CCC(=O)O[Si](C)(C)C)=C(CC3=C(CCC(=O)O[Si](C)(C)C)C(C)=C(/C=C4/C(C=C)=C(C)C(=O)N4[Si](C)(C)C)[NH]3)N2[Si](C)(C)C)NC1=O | TMS | 872.4216 | Semi standard non polar | 4841.5825 |
RI00003091 | Bilirubin,4TMS,isomer#3 | JsmolC=CC1=C(C)/C(=C/C2=C(C)C(CCC(=O)O[Si](C)(C)C)=C(CC3=C(CCC(=O)O[Si](C)(C)C)C(C)=C(/C=C4\NC(=O)C(C)=C4C=C)[NH]3)N2[Si](C)(C)C)N([Si](C)(C)C)C1=O | TMS | 872.4216 | Semi standard non polar | 4842.837 |
RI00003092 | Bilirubin,4TMS,isomer#4 | JsmolC=CC1=C(C)/C(=C/C2=C(C)C(CCC(=O)O[Si](C)(C)C)=C(CC3=C(CCC(=O)O[Si](C)(C)C)C(C)=C(/C=C4/C(C=C)=C(C)C(=O)N4[Si](C)(C)C)N3[Si](C)(C)C)[NH]2)NC1=O | TMS | 872.4216 | Semi standard non polar | 4851.453 |
RI00003093 | Bilirubin,4TMS,isomer#5 | JsmolC=CC1=C(C)/C(=C/C2=C(C)C(CCC(=O)O[Si](C)(C)C)=C(CC3=C(CCC(=O)O[Si](C)(C)C)C(C)=C(/C=C4\NC(=O)C(C)=C4C=C)N3[Si](C)(C)C)[NH]2)N([Si](C)(C)C)C1=O | TMS | 872.4216 | Semi standard non polar | 4835.891 |
RI00003094 | Bilirubin,4TMS,isomer#6 | JsmolC=CC1=C(C)/C(=C/C2=C(C)C(CCC(=O)O[Si](C)(C)C)=C(CC3=C(CCC(=O)O[Si](C)(C)C)C(C)=C(/C=C4/C(C=C)=C(C)C(=O)N4[Si](C)(C)C)[NH]3)[NH]2)N([Si](C)(C)C)C1=O | TMS | 872.4216 | Semi standard non polar | 4659.7837 |
RI00003095 | Bilirubin,4TMS,isomer#7 | JsmolC=CC1=C(C)/C(=C/C2=C(C)C(CCC(=O)O)=C(CC3=C(CCC(=O)O[Si](C)(C)C)C(C)=C(/C=C4/C(C=C)=C(C)C(=O)N4[Si](C)(C)C)N3[Si](C)(C)C)N2[Si](C)(C)C)NC1=O | TMS | 872.4216 | Semi standard non polar | 4943.238 |
RI00003096 | Bilirubin,4TMS,isomer#8 | JsmolC=CC1=C(C)/C(=C/C2=C(C)C(CCC(=O)O)=C(CC3=C(CCC(=O)O[Si](C)(C)C)C(C)=C(/C=C4\NC(=O)C(C)=C4C=C)N3[Si](C)(C)C)N2[Si](C)(C)C)N([Si](C)(C)C)C1=O | TMS | 872.4216 | Semi standard non polar | 4935.161 |
RI00003097 | Bilirubin,4TMS,isomer#9 | JsmolC=CC1=C(C)/C(=C/C2=C(C)C(CCC(=O)O)=C(CC3=C(CCC(=O)O[Si](C)(C)C)C(C)=C(/C=C4/C(C=C)=C(C)C(=O)N4[Si](C)(C)C)[NH]3)N2[Si](C)(C)C)N([Si](C)(C)C)C1=O | TMS | 872.4216 | Semi standard non polar | 4736.236 |
RI00003098 | Bilirubin,4TMS,isomer#10 | JsmolC=CC1=C(C)/C(=C/C2=C(C)C(CCC(=O)O)=C(CC3=C(CCC(=O)O[Si](C)(C)C)C(C)=C(/C=C4/C(C=C)=C(C)C(=O)N4[Si](C)(C)C)N3[Si](C)(C)C)[NH]2)N([Si](C)(C)C)C1=O | TMS | 872.4216 | Semi standard non polar | 4735.767 |
RI00003099 | Bilirubin,4TMS,isomer#11 | JsmolC=CC1=C(C)/C(=C/C2=C(C)C(CCC(=O)O[Si](C)(C)C)=C(CC3=C(CCC(=O)O)C(C)=C(/C=C4/C(C=C)=C(C)C(=O)N4[Si](C)(C)C)N3[Si](C)(C)C)N2[Si](C)(C)C)NC1=O | TMS | 872.4216 | Semi standard non polar | 4942.9336 |
RI00003100 | Bilirubin,4TMS,isomer#12 | JsmolC=CC1=C(C)/C(=C/C2=C(C)C(CCC(=O)O[Si](C)(C)C)=C(CC3=C(CCC(=O)O)C(C)=C(/C=C4\NC(=O)C(C)=C4C=C)N3[Si](C)(C)C)N2[Si](C)(C)C)N([Si](C)(C)C)C1=O | TMS | 872.4216 | Semi standard non polar | 4935.5015 |