RI01721551 | Difelikefalin,3TMS,isomer#18 | JsmolCC(C)C[C@@H](NC(=O)[C@@H](CC1=CC=CC=C1)N(C(=O)[C@H](N)CC1=CC=CC=C1)[Si](C)(C)C)C(=O)N([C@H](CCCCN)C(=O)N1CCC(N)(C(=O)O[Si](C)(C)C)CC1)[Si](C)(C)C | TMS | 895.5243 | Standard non polar | 4613.2734 |
RI01721550 | Difelikefalin,3TMS,isomer#17 | JsmolCC(C)C[C@H](C(=O)N[C@H](CCCCN)C(=O)N1CCC(N)(C(=O)O[Si](C)(C)C)CC1)N(C(=O)[C@@H](CC1=CC=CC=C1)N(C(=O)[C@H](N)CC1=CC=CC=C1)[Si](C)(C)C)[Si](C)(C)C | TMS | 895.5243 | Standard non polar | 4626.4116 |
RI01721549 | Difelikefalin,3TMS,isomer#16 | JsmolCC(C)C[C@H](C(=O)N([C@H](CCCCN)C(=O)N1CCC(N)(C(=O)O[Si](C)(C)C)CC1)[Si](C)(C)C)N(C(=O)[C@@H](CC1=CC=CC=C1)NC(=O)[C@H](N)CC1=CC=CC=C1)[Si](C)(C)C | TMS | 895.5243 | Standard non polar | 4593.029 |
RI01721548 | Difelikefalin,3TMS,isomer#15 | JsmolCC(C)C[C@@H](NC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)[C@H](N)CC1=CC=CC=C1)C(=O)N[C@H](CCCCN)C(=O)N1CCC(C(=O)O[Si](C)(C)C)(N([Si](C)(C)C)[Si](C)(C)C)CC1 | TMS | 895.5243 | Standard non polar | 4784.8716 |
RI01721547 | Difelikefalin,3TMS,isomer#14 | JsmolCC(C)C[C@@H](NC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)[C@H](N)CC1=CC=CC=C1)C(=O)N([C@H](CCCCN)C(=O)N1CCC(N[Si](C)(C)C)(C(=O)O[Si](C)(C)C)CC1)[Si](C)(C)C | TMS | 895.5243 | Standard non polar | 4684.6914 |
RI01721546 | Difelikefalin,3TMS,isomer#13 | JsmolCC(C)C[C@@H](NC(=O)[C@@H](CC1=CC=CC=C1)N(C(=O)[C@H](N)CC1=CC=CC=C1)[Si](C)(C)C)C(=O)N[C@H](CCCCN)C(=O)N1CCC(N[Si](C)(C)C)(C(=O)O[Si](C)(C)C)CC1 | TMS | 895.5243 | Standard non polar | 4726.9946 |
RI01721545 | Difelikefalin,3TMS,isomer#12 | JsmolCC(C)C[C@H](C(=O)N[C@H](CCCCN)C(=O)N1CCC(N[Si](C)(C)C)(C(=O)O[Si](C)(C)C)CC1)N(C(=O)[C@@H](CC1=CC=CC=C1)NC(=O)[C@H](N)CC1=CC=CC=C1)[Si](C)(C)C | TMS | 895.5243 | Standard non polar | 4702.1123 |
RI01721544 | Difelikefalin,3TMS,isomer#11 | JsmolCC(C)C[C@@H](NC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)[C@H](N)CC1=CC=CC=C1)C(=O)N[C@H](CCCCN([Si](C)(C)C)[Si](C)(C)C)C(=O)N1CCC(N)(C(=O)O[Si](C)(C)C)CC1 | TMS | 895.5243 | Standard non polar | 4767.9727 |
RI01721543 | Difelikefalin,3TMS,isomer#10 | JsmolCC(C)C[C@@H](NC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)[C@H](N)CC1=CC=CC=C1)C(=O)N([C@H](CCCCN[Si](C)(C)C)C(=O)N1CCC(N)(C(=O)O[Si](C)(C)C)CC1)[Si](C)(C)C | TMS | 895.5243 | Standard non polar | 4663.424 |
RI01721542 | Difelikefalin,3TMS,isomer#9 | JsmolCC(C)C[C@@H](NC(=O)[C@@H](CC1=CC=CC=C1)N(C(=O)[C@H](N)CC1=CC=CC=C1)[Si](C)(C)C)C(=O)N[C@H](CCCCN[Si](C)(C)C)C(=O)N1CCC(N)(C(=O)O[Si](C)(C)C)CC1 | TMS | 895.5243 | Standard non polar | 4703.3647 |
RI01721541 | Difelikefalin,3TMS,isomer#8 | JsmolCC(C)C[C@H](C(=O)N[C@H](CCCCN[Si](C)(C)C)C(=O)N1CCC(N)(C(=O)O[Si](C)(C)C)CC1)N(C(=O)[C@@H](CC1=CC=CC=C1)NC(=O)[C@H](N)CC1=CC=CC=C1)[Si](C)(C)C | TMS | 895.5243 | Standard non polar | 4684.525 |
RI01721540 | Difelikefalin,3TMS,isomer#7 | JsmolCC(C)C[C@@H](NC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)[C@H](N)CC1=CC=CC=C1)C(=O)N[C@H](CCCCN[Si](C)(C)C)C(=O)N1CCC(N[Si](C)(C)C)(C(=O)O[Si](C)(C)C)CC1 | TMS | 895.5243 | Standard non polar | 4820.945 |
RI01721539 | Difelikefalin,3TMS,isomer#6 | JsmolCC(C)C[C@@H](NC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)[C@@H](CC1=CC=CC=C1)N[Si](C)(C)C)C(=O)N([C@H](CCCCN)C(=O)N1CCC(N)(C(=O)O[Si](C)(C)C)CC1)[Si](C)(C)C | TMS | 895.5243 | Standard non polar | 4655.3623 |
RI01721538 | Difelikefalin,3TMS,isomer#5 | JsmolCC(C)C[C@@H](NC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)[C@@H](CC1=CC=CC=C1)N([Si](C)(C)C)[Si](C)(C)C)C(=O)N[C@H](CCCCN)C(=O)N1CCC(N)(C(=O)O[Si](C)(C)C)CC1 | TMS | 895.5243 | Standard non polar | 4773.2725 |
RI01721537 | Difelikefalin,3TMS,isomer#4 | JsmolCC(C)C[C@@H](NC(=O)[C@@H](CC1=CC=CC=C1)N(C(=O)[C@@H](CC1=CC=CC=C1)N[Si](C)(C)C)[Si](C)(C)C)C(=O)N[C@H](CCCCN)C(=O)N1CCC(N)(C(=O)O[Si](C)(C)C)CC1 | TMS | 895.5243 | Standard non polar | 4696.602 |
RI01721536 | Difelikefalin,3TMS,isomer#3 | JsmolCC(C)C[C@H](C(=O)N[C@H](CCCCN)C(=O)N1CCC(N)(C(=O)O[Si](C)(C)C)CC1)N(C(=O)[C@@H](CC1=CC=CC=C1)NC(=O)[C@@H](CC1=CC=CC=C1)N[Si](C)(C)C)[Si](C)(C)C | TMS | 895.5243 | Standard non polar | 4676.018 |
RI01721535 | Difelikefalin,3TMS,isomer#2 | JsmolCC(C)C[C@@H](NC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)[C@@H](CC1=CC=CC=C1)N[Si](C)(C)C)C(=O)N[C@H](CCCCN)C(=O)N1CCC(N[Si](C)(C)C)(C(=O)O[Si](C)(C)C)CC1 | TMS | 895.5243 | Standard non polar | 4813.797 |
RI01721534 | Difelikefalin,3TMS,isomer#1 | JsmolCC(C)C[C@@H](NC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)[C@@H](CC1=CC=CC=C1)N[Si](C)(C)C)C(=O)N[C@H](CCCCN[Si](C)(C)C)C(=O)N1CCC(N)(C(=O)O[Si](C)(C)C)CC1 | TMS | 895.5243 | Standard non polar | 4773.798 |
RI01721533 | Difelikefalin,2TMS,isomer#24 | JsmolCC(C)C[C@@H](NC(=O)[C@@H](CC1=CC=CC=C1)N(C(=O)[C@H](N)CC1=CC=CC=C1)[Si](C)(C)C)C(=O)N([C@H](CCCCN)C(=O)N1CCC(N)(C(=O)O)CC1)[Si](C)(C)C | TMS | 823.4848 | Standard non polar | 4758.041 |
RI01721532 | Difelikefalin,2TMS,isomer#23 | JsmolCC(C)C[C@H](C(=O)N[C@H](CCCCN)C(=O)N1CCC(N)(C(=O)O)CC1)N(C(=O)[C@@H](CC1=CC=CC=C1)N(C(=O)[C@H](N)CC1=CC=CC=C1)[Si](C)(C)C)[Si](C)(C)C | TMS | 823.4848 | Standard non polar | 4760.1313 |
RI01721531 | Difelikefalin,2TMS,isomer#22 | JsmolCC(C)C[C@H](C(=O)N([C@H](CCCCN)C(=O)N1CCC(N)(C(=O)O)CC1)[Si](C)(C)C)N(C(=O)[C@@H](CC1=CC=CC=C1)NC(=O)[C@H](N)CC1=CC=CC=C1)[Si](C)(C)C | TMS | 823.4848 | Standard non polar | 4715.4077 |
RI01721530 | Difelikefalin,2TMS,isomer#21 | JsmolCC(C)C[C@@H](NC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)[C@H](N)CC1=CC=CC=C1)C(=O)N[C@H](CCCCN)C(=O)N1CCC(C(=O)O)(N([Si](C)(C)C)[Si](C)(C)C)CC1 | TMS | 823.4848 | Standard non polar | 4898.5913 |
RI01721529 | Difelikefalin,2TMS,isomer#20 | JsmolCC(C)C[C@@H](NC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)[C@H](N)CC1=CC=CC=C1)C(=O)N([C@H](CCCCN)C(=O)N1CCC(N[Si](C)(C)C)(C(=O)O)CC1)[Si](C)(C)C | TMS | 823.4848 | Standard non polar | 4824.584 |
RI01721528 | Difelikefalin,2TMS,isomer#19 | JsmolCC(C)C[C@@H](NC(=O)[C@@H](CC1=CC=CC=C1)N(C(=O)[C@H](N)CC1=CC=CC=C1)[Si](C)(C)C)C(=O)N[C@H](CCCCN)C(=O)N1CCC(N[Si](C)(C)C)(C(=O)O)CC1 | TMS | 823.4848 | Standard non polar | 4868.5513 |
RI01721527 | Difelikefalin,2TMS,isomer#18 | JsmolCC(C)C[C@H](C(=O)N[C@H](CCCCN)C(=O)N1CCC(N[Si](C)(C)C)(C(=O)O)CC1)N(C(=O)[C@@H](CC1=CC=CC=C1)NC(=O)[C@H](N)CC1=CC=CC=C1)[Si](C)(C)C | TMS | 823.4848 | Standard non polar | 4830.6836 |