0 B17R1.4465 C(N)(CC1=CC=C(C=C1)OC(C)(C)C)C(=O)O MCULE-1789489195 [0,0,0,0,0,0|4,0,0]=4 1 B17R1.4465 CC(C)(C)OC1=CC=C(C=C1)CC(N)C(=O)O MCULE-2265476978 [0,0,0,0,0,0|4,0,0]=4 2 B17R1.4465 CC(C)(C)OC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-3484086192 [0,0,0,0,0,0|4,0,0]=4 3 B17R1.4465 CC(C)(C)OC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-6704811233 [0,0,0,0,0,0|4,0,0]=4 4 B17R1.4465 CS(=O)(=O)NC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-7615321495 [0,0,0,0,0,0|3,0,1]=4 5 B17R1.4465 CS(=O)(=O)NC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-9533881453 [0,0,0,0,0,0|3,0,1]=4 6 B17R1.4465 NC(CC1=CC=C(C=C1)CP(=O)(O)O)C(=O)O MCULE-3585296792 [0,0,0,0,0,0|1,0,0]=1 7 B17R1.4465 NC(CC1=CC=C(C=C1)OC(F)(F)F)C(=O)O MCULE-4941958020 [0,0,0,0,0,0|4,0,0]=4 8 B17R1.4465 NC(CC1=CC=C(C=C1)OC(F)(F)F)C(=O)O MCULE-5201829550 [0,0,0,0,0,0|4,0,0]=4 9 B17R1.4465 NC(CC1=CC=C(C=C1)OC(F)(F)F)C(=O)O MCULE-5755216772 [0,0,0,0,0,0|4,0,0]=4 10 B17R1.4465 NC(CC1=CC=C(C=C1)OC(F)(F)F)C(=O)O MCULE-8068349019 [0,0,0,0,0,0|4,0,0]=4 11 B17R1.4465 NC(CC1=CC=C(C=C1)OC(F)(F)F)C(=O)O MCULE-8827714235 [0,0,0,0,0,0|4,0,0]=4 12 B17R1.4465 NC(CC1=CC=C(C=C1)OP(=O)(O)O)C(=O)O MCULE-9408230143 [0,0,0,0,0,0|0,0,0]=0 13 B17R1.4465 N[C@@H](CC1=CC=C(C=C1)CP(=O)(O)O)C(=O)O MCULE-6644652645 [0,0,0,0,0,0|1,0,0]=1 14 B17R1.4465 N[C@@H](CC1=CC=C(C=C1)OC(F)(F)F)C(=O)O MCULE-2599340572 [0,0,0,0,0,0|4,0,0]=4 15 B17R1.4465 N[C@@H](CC1=CC=C(C=C1)OC(F)(F)F)C(=O)O MCULE-3341135739 [0,0,0,0,0,0|4,0,0]=4 16 B17R1.4465 N[C@@H](CC1=CC=C(C=C1)OC(F)(F)F)C(=O)O MCULE-5856922000 [0,0,0,0,0,0|4,0,0]=4 17 B17R1.4465 N[C@@H](CC1=CC=C(C=C1)OC(F)(F)F)C(=O)O MCULE-9643074653 [0,0,0,0,0,0|4,0,0]=4 18 B17R1.4465 N[C@@H](CC1=CC=C(C=C1)OP(=O)(O)O)C(=O)O MCULE-7522108305 [0,0,0,0,0,0|0,0,0]=0 19 B17R1.4465 N[C@@H](CC1=CC=C(C=C1)OP(=O)(O)O)C(=O)O MCULE-8059662807 [0,0,0,0,0,0|0,0,0]=0 20 B17R1.4465 N[C@@H](CC1=CC=C(C=C1)OP(=O)([O-])O)C(=O)[O-] MCULE-4279696118 [0,0,0,0,0,0|0,0,2]=2 21 B17R1.4465 N[C@@H](CC1=CC=C(C=C1)OP(=O)([O-])O)C(=O)[O-] MCULE-4673907697 [0,0,0,0,0,0|0,0,2]=2 22 B17R1.4465 N[C@@H](CC1=CC=C(C=C1)OS(=O)(=O)F)C(=O)O MCULE-1704343283 [0,0,0,0,0,0|2,0,1]=3 23 B17R1.4465 N[C@@H](CC1=CC=C(C=C1)OS(=O)(=O)F)C(=O)O MCULE-4385943471 [0,0,0,0,0,0|2,0,1]=3 24 B17R1.4465 N[C@@H](CC1=CC=C(C=C1)OS(=O)(=O)F)C(=O)O MCULE-5321662469 [0,0,0,0,0,0|2,0,1]=3 25 B17R1.4465 N[C@@H](CC1=CC=C(C=C1)OS(=O)(=O)F)C(=O)O MCULE-8106039279 [0,0,0,0,0,0|2,0,1]=3 26 B17R1.4465 N[C@@H](CC1=CC=C(C=C1)OS(=O)(=O)O)C(=O)O MCULE-8650841843 [0,0,0,0,0,0|1,0,1]=2 27 B17R1.4465 N[C@H](CC1=CC=C(C=C1)CP(=O)(O)O)C(=O)O MCULE-3706476608 [0,0,0,0,0,0|1,0,0]=1 28 B17R1.4465 N[C@H](CC1=CC=C(C=C1)OC(F)(F)F)C(=O)O MCULE-3753814195 [0,0,0,0,0,0|4,0,0]=4 29 B17R1.4465 N[C@H](CC1=CC=C(C=C1)OC(F)(F)F)C(=O)O MCULE-4082336276 [0,0,0,0,0,0|4,0,0]=4 30 B17R1.4465 N[C@H](CC1=CC=C(C=C1)OC(F)(F)F)C(=O)O MCULE-9926201843 [0,0,0,0,0,0|4,0,0]=4 31 B17R1.4465 N[C@H](CC1=CC=C(C=C1)OP(=O)(O)O)C(=O)O MCULE-7058971516 [0,0,0,0,0,0|0,0,0]=0 32 B17R1.4465 [C@@H](N)(CC1=CC=C(C=C1)OC(C)(C)C)C(=O)O MCULE-2697261287 [0,0,0,0,0,0|4,0,0]=4 33 B17R1.4465 [C@H](N)(CC1=CC=C(C=C1)OC(C)(C)C)C(=O)O MCULE-4478617713 [0,0,0,0,0,0|4,0,0]=4 34 B17R1.4465 [C@H](N)(CC1=CC=C(C=C1)OS(=O)(=O)O)C(=O)O MCULE-7044254507 [0,0,0,0,0,0|1,0,1]=2 35 B16R1.1283 CC(=O)NC1=CC=C(C=C1)CC(N)C(=O)O MCULE-7308107561 [1,0,0,0,0,0|3,0,0]=4 36 B16R1.1283 CC(=O)NC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-3618846847 [1,0,0,0,0,0|3,0,0]=4 37 B16R1.1283 CC(=O)NC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-7205617791 [1,0,0,0,0,0|3,0,0]=4 38 B16R1.1283 CC(=O)OC1=CC=C(C=C1)CC(N)C(=O)O MCULE-1172152580 [1,0,0,0,0,0|2,0,0]=3 39 B16R1.1283 CC(=O)OC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-3018713336 [1,0,0,0,0,0|2,0,0]=3 40 B16R1.1283 CC(=O)OC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-4659925496 [1,0,0,0,0,0|2,0,0]=3 41 B16R1.1283 CC(C)OC1=CC=C(C=C1)CC(N)C(=O)O MCULE-6279573560 [1,0,0,0,0,0|3,0,0]=4 42 B16R1.1283 NC(CC1=CC=C(C=C1)CC(=O)O)C(=O)O MCULE-3747924032 [1,0,0,0,0,0|2,0,0]=3 43 B16R1.1283 NC(CC1=CC=C(C=C1)CC(=O)O)C(=O)O MCULE-8656667288 [1,0,0,0,0,0|2,0,0]=3 44 B16R1.1283 NC(CC1=CC=C(C=C1)OC(F)F)C(=O)O MCULE-1813685776 [1,0,0,0,0,0|3,0,0]=4 45 B16R1.1283 N[C@@H](CC1=CC=C(C=C1)CC(=O)O)C(=O)O MCULE-4793562474 [1,0,0,0,0,0|2,0,0]=3 46 B16R1.1283 [C@H](N)(CC1=CC=C(C=C1)CC(=O)O)C(=O)O MCULE-4788788360 [1,0,0,0,0,0|2,0,0]=3 47 B18R2.141924 CC1(OC2=C(O1)C=C(C=C2)CC(N)C(=O)O)C MCULE-6732617137 [0,0,0,1,0,0|3,0,0]=4 48 B18R2.141924 CC1(OC2=C(O1)C=C(C=C2)C[C@@H](N)C(=O)O)C MCULE-9143337713 [0,0,0,1,0,0|3,0,0]=4 49 B18R2.141924 CC1(OC2=CC=C(C=C2O1)C[C@H](N)C(=O)O)C MCULE-8216210712 [0,0,0,1,0,0|3,0,0]=4 50 B18R2.141924 NC(CC1=CC=C2OC(OC2=C1)(F)F)C(=O)O MCULE-1159412352 [0,0,0,1,0,0|3,0,0]=4 51 B18R2.141924 NC(CC1=CC=C2OC(OC2=C1)(F)F)C(=O)O MCULE-1241072097 [0,0,0,1,0,0|3,0,0]=4 52 B16R1.4113 CS(=O)(=O)C1=CC=C(C=C1)CC(N)C(=O)O MCULE-5979473657 [0,0,0,0,1,0|2,0,1]=4 53 B16R1.4113 CS(=O)(=O)C1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-7571424103 [0,0,0,0,1,0|2,0,1]=4 54 B16R1.4113 NC(CC1=CC=C(C=C1)S(=O)(=O)O)C(=O)O MCULE-7295232096 [0,0,0,0,1,0|1,0,1]=3 55 B16R1.4113 N[C@@H](CC1=CC=C(C=C1)P(=O)(O)O)C(=O)O MCULE-9567067330 [0,0,0,0,1,0|0,0,0]=1 56 B16R1.4113 N[C@@H](CC1=CC=C(C=C1)S(=O)(=O)O)C(=O)O MCULE-1306037587 [0,0,0,0,1,0|1,0,1]=3 57 B16R1.4113 N[C@@H](CC1=CC=C(C=C1)S(=O)(=O)O)C(=O)O MCULE-6505770058 [0,0,0,0,1,0|1,0,1]=3 58 B16R1.4113 N[C@H](CC1=CC=C(C=C1)P(=O)(O)O)C(=O)O MCULE-9670635939 [0,0,0,0,1,0|0,0,0]=1 59 B15R1.16 CCOC1=CC=C(C=C1)CC(N)C(=O)O MCULE-4474170078 [2,0,0,0,0,0|2,0,0]=4 60 B15R1.16 CCOC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-4177099907 [2,0,0,0,0,0|2,0,0]=4 61 B15R1.16 CCOC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-7871331679 [2,0,0,0,0,0|2,0,0]=4 62 B15R1.16 CCOC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-6155700571 [2,0,0,0,0,0|2,0,0]=4 63 B15R1.16 CCOC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-9752442085 [2,0,0,0,0,0|2,0,0]=4 64 B15R1.499 CC(=O)OC1=CC=C(C=C1)CCC(=O)O MCULE-6472862414 [2,0,0,0,0,0|2,0,0]=4 65 B19R1.4096 N[C@@H](CC1=CC=C(C=C1)C(F)(F)P(=O)(O)O)C(=O)O MCULE-7947598844 [0,2,0,0,0,0|1,0,0]=3 66 B17R2.4858 NC(CC1=CC2=C(C=C1)OC(=O)N2)C(=O)O MCULE-4234215701 [1,0,0,1,0,0|2,0,0]=4 67 B17R2.4858 N[C@@H](CC1=CC2=C(C=C1)OC(=O)N2)C(=O)O MCULE-5042800181 [1,0,0,1,0,0|2,0,0]=4 68 B17R2.4858 N[C@@H](CC1=CC2=C(C=C1)OC(=O)N2)C(=O)O MCULE-7507870528 [1,0,0,1,0,0|2,0,0]=4 69 B15R1.495 C(N)(CC1=CC=C(C=C1)B(O)O)C(=O)O MCULE-9323204289 [1,0,0,0,1,0|1,0,0]=3 70 B15R1.495 CC(=O)C1=CC=C(C=C1)CC(N)C(=O)O MCULE-6950657193 [1,0,0,0,1,0|2,0,0]=4 71 B15R1.495 CC(=O)C1=CC=C(C=C1)CC(N)C(=O)O MCULE-8807354935 [1,0,0,0,1,0|2,0,0]=4 72 B15R1.495 CC(=O)C1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-1782603905 [1,0,0,0,1,0|2,0,0]=4 73 B15R1.495 CC(=O)C1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-8569330100 [1,0,0,0,1,0|2,0,0]=4 74 B15R1.495 CC(=O)C1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-1220877169 [1,0,0,0,1,0|2,0,0]=4 75 B15R1.495 CC(=O)C1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-2753524221 [1,0,0,0,1,0|2,0,0]=4 76 B15R1.495 CC(=O)C1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-4025064471 [1,0,0,0,1,0|2,0,0]=4 77 B15R1.495 CC(=O)C1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-8797522346 [1,0,0,0,1,0|2,0,0]=4 78 B15R1.495 NC(=O)C1=CC=C(C=C1)CC(N)C(=O)O MCULE-7278608683 [1,0,0,0,1,0|2,0,0]=4 79 B15R1.495 NC(=O)C1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-4186619996 [1,0,0,0,1,0|2,0,0]=4 80 B15R1.495 NC(=O)C1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-4883051060 [1,0,0,0,1,0|2,0,0]=4 81 B15R1.495 NC(=O)C1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-1392937896 [1,0,0,0,1,0|2,0,0]=4 82 B15R1.495 NC(=O)C1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-3581109554 [1,0,0,0,1,0|2,0,0]=4 83 B15R1.495 NC(CC1=CC=C(C=C1)B(O)O)C(=O)O MCULE-2970291581 [1,0,0,0,1,0|1,0,0]=3 84 B15R1.495 NC(CC1=CC=C(C=C1)C(=O)O)C(=O)O MCULE-8431079171 [1,0,0,0,1,0|1,0,0]=3 85 B15R1.495 NC(CC1=CC=C(C=C1)N(=O)=O)C(=O)O MCULE-2273600120 [1,0,0,0,1,0|0,1,1]=4 86 B15R1.495 NC(CC1=CC=C(C=C1)N(=O)=O)C(=O)O MCULE-5071164478 [1,0,0,0,1,0|0,1,1]=4 87 B15R1.495 NC(CC1=CC=C(C=C1)N(=O)=O)C(=O)O MCULE-6247112607 [1,0,0,0,1,0|0,1,1]=4 88 B15R1.495 N[C@@H](CC1=CC=C(C=C1)B(O)O)C(=O)O MCULE-6531307541 [1,0,0,0,1,0|1,0,0]=3 89 B15R1.495 N[C@@H](CC1=CC=C(C=C1)B(O)O)C(=O)O MCULE-7671849018 [1,0,0,0,1,0|1,0,0]=3 90 B15R1.495 N[C@@H](CC1=CC=C(C=C1)C(=O)O)C(=O)O MCULE-2408168813 [1,0,0,0,1,0|1,0,0]=3 91 B15R1.495 N[C@@H](CC1=CC=C(C=C1)C(=O)O)C(=O)O MCULE-7535447371 [1,0,0,0,1,0|1,0,0]=3 92 B15R1.495 N[C@@H](CC1=CC=C(C=C1)C(=O)O)C(=O)O MCULE-9954201924 [1,0,0,0,1,0|1,0,0]=3 93 B15R1.495 N[C@@H](CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)O MCULE-1693855897 [1,0,0,0,1,0|0,1,1]=4 94 B15R1.495 N[C@@H](CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)O MCULE-3511055155 [1,0,0,0,1,0|0,1,1]=4 95 B15R1.495 N[C@@H](CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)O MCULE-8831767805 [1,0,0,0,1,0|0,1,1]=4 96 B15R1.495 N[C@H](CC1=CC=C(C=C1)B(O)O)C(=O)O MCULE-6395401693 [1,0,0,0,1,0|1,0,0]=3 97 B15R1.495 N[C@H](CC1=CC=C(C=C1)B(O)O)C(=O)O MCULE-7353945301 [1,0,0,0,1,0|1,0,0]=3 98 B15R1.495 N[C@H](CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)O MCULE-2856704024 [1,0,0,0,1,0|0,1,1]=4 99 B15R1.495 N[C@H](CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)O MCULE-3581843023 [1,0,0,0,1,0|0,1,1]=4 100 B15R1.495 N[C@H](CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)O MCULE-4275372069 [1,0,0,0,1,0|0,1,1]=4 101 B15R1.495 N[C@H](CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)O MCULE-9556380283 [1,0,0,0,1,0|0,1,1]=4 102 B15R1.495 [C@H](N)(CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)O MCULE-3738503916 [1,0,0,0,1,0|0,1,1]=4 103 B15R1.498 O=C(O)CNC1=CC=C(C=C1)P(=O)(O)O MCULE-4725051485 [1,0,0,0,1,0|1,0,0]=3 104 B15R1.3665 NC(C(=O)O)C1=CC=C(C=C1)P(=O)(O)O MCULE-9977357613 [0,0,0,0,2,0|0,0,0]=2