0 B8R0.21 CC(C)(S)CCOC=O AK297149 [1,0,0,0,0,0|2,0,0]=3 1 B8R0.24 C[N+](C)(C)CC(O)CCl AK117117 [1,0,0,0,0,0|3,0,0]=4 2 B8R0.24 C[N+](C)(C)CC(O)CO AK544946 [1,0,0,0,0,0|2,0,1]=4 3 B10R0.31 CC(C)(C)OC(=O)CC(O)=O AK-44842 [0,1,0,0,0,0|2,0,1]=4 4 B10R0.31 CC(CC(OC(C)(C)C)=O)=O AK106196 [0,1,0,0,0,0|2,0,1]=4 5 B10R0.31 C[N+](C)(C)C[C@H](O)CC(O)=O AK101175 [0,1,0,0,0,0|2,0,0]=3 6 B10R0.31 C[N+](C)(C)C[C@H](O)CC(O)=O AK164495 [0,1,0,0,0,0|2,0,0]=3 7 B10R0.31 OC(C[N+](C)(C)C)CC([O-])=O AK113129 [0,1,0,0,0,0|2,0,0]=3 8 B10R0.31 OC(C[N+](C)(C)C)CC([O-])=O AK163426 [0,1,0,0,0,0|2,0,0]=3 9 B10R1.329 CC1(C)CC(=O)NC(=O)C1 AK-80204 [0,0,0,1,0,0|2,0,1]=4 10 B10R1.329 O=C1CC(C)(C)CC(C)C1 AK122426 [0,0,0,1,0,0|0,0,0]=1 11 B10R1.329 O=C1CC(CC(C)(C)C1)=O AK-33057 [0,0,0,1,0,0|1,0,1]=3 12 B10R1.329 OC1CC(C)(C)CC(C)C1 AK117244 [0,0,0,1,0,0|0,0,2]=3 13 B7R0.2 N[C@@H](CC(C)C)CO AK-47555 [2,0,0,0,0,0|1,0,1]=4 14 B7R0.2 N[C@H](CC(C)C)CO AK-43973 [2,0,0,0,0,0|1,0,1]=4 15 B7R0.8 CCCC[N+](C)(C)C AK-59431 [2,0,0,0,0,0|1,0,1]=4 16 B9R0.53 CC(C)CC(N)CC(O)=O AK-34862 [1,1,0,0,0,0|1,0,0]=3 17 B9R0.53 CC(C)C[C@H](N)CC(O)=O AK-44602 [1,1,0,0,0,0|1,0,0]=3 18 B9R0.53 CC(C)C[C@H](N)CC(O)=O AK-89143 [1,1,0,0,0,0|1,0,0]=3 19 B9R0.56 CC(=O)SCC[N+](C)(C)C AK-47972 [1,1,0,0,0,0|2,0,0]=4 20 B9R0.56 C[N+](C)(C)CCOC(C)=O AK307467 [1,1,0,0,0,0|2,0,0]=4 21 B9R0.56 O=C([O-])CCN[N+](C)(C)C AK276866 [1,1,0,0,0,0|2,0,0]=4 22 B9R0.57 CC(C)(C)C[C@@H](N)C(O)=O AK130118 [1,1,0,0,0,0|1,0,0]=3 23 B9R0.57 CC(C)(F)C[C@H](N)C(O)=O AK314940 [1,1,0,0,0,0|2,0,0]=4 24 B9R0.16 C[Si](C(C)(C)C)(CC=C)C AK550907 [0,1,0,0,1,0|1,1,0]=4 25 B11R0.186 O=C(OC(C)(C)C)N(C)CC=O AK-40283 [0,1,0,0,0,1|1,0,1]=4 26 B11R0.337 O=C(O)C[C@@H](N)COC(C)(C)C AK481190 [0,1,0,0,0,1|1,0,0]=3 27 B11R0.308 C[C@@H](OC(C)(C)C)[C@@H](N)C(O)=O AK186428 [0,2,0,0,0,0|1,0,0]=3 28 B11R0.308 C[C@H](OC(C)(C)C)[C@H](N)C(O)=O AK174592 [0,2,0,0,0,0|1,0,0]=3 29 B11R0.308 N[C@H]([C@@H](OC(C)(C)C)C)C(O)=O AK-88973 [0,2,0,0,0,0|1,0,0]=3 30 B11R0.308 [C@H](C)(OC(C)(C)C)[C@H](N)C(O)=O AK-45262 [0,2,0,0,0,0|1,0,0]=3 31 B9R1.34 CC1CC(C)CC(O)C1 AK103636 [1,0,0,1,0,0|0,0,2]=4 32 B9R1.133 O=C[C@H]1OC(C)(C)OC1 AK142723 [1,0,0,1,0,0|2,0,0]=4 33 B11R1.1362 O=C1CC(C)(C)CC(C)(C)C1 AK126690 [0,1,0,1,0,0|0,0,0]=2 34 B11R1.1362 O=C1CC(C)(C)NC(C)(C)C1 AK-88800 [0,1,0,1,0,0|1,0,0]=3 35 B11R1.1362 O=C1CC(C)(C)NC(C)(C)C1 AK114147 [0,1,0,1,0,0|1,0,0]=3 36 B11R1.1361 CC1CC(C)(C)CC(=O)C1=O AK109604 [0,1,0,1,0,0|0,0,1]=3 37 B7R0.14 N[C@@H](C(C)(C)C)CO AK-41272 [1,0,0,0,1,0|1,0,1]=4 38 B7R0.14 N[C@H](C(C)(C)C)CO AK-45084 [1,0,0,0,1,0|1,0,1]=4