0 B6R0.2 CC(=O)CC(=O)O HY-112540 [0,0,0,0,0,0|2,0,1]=3 1 B6R0.2 CC(C)=CC(=O)O HY-W010611 [0,0,0,0,0,0|1,0,0]=1 2 B6R0.2 CC(C)CC(=O)O HY-W012980R [0,0,0,0,0,0|1,0,2]=3 3 B6R0.2 CC(C)NC(C)C HY-B2210 [0,0,0,0,0,0|2,0,2]=4 4 B5R0.1 CNCC(=O)O HY-W012791 [1,0,0,0,0,0|2,0,1]=4 5 B5R0.1 C\C=C\C(C)=O HY-34748 [1,0,0,0,0,0|0,0,0]=1 6 B7R0.9 CC(C)(O)CC(=O)O HY-113409 [0,1,0,0,0,0|1,0,2]=4 7 B7R0.9 C[N+](C)(C)CC(=O)[O-] HY-B0710R [0,1,0,0,0,0|2,0,1]=4 8 B7R0.16 CC(C)C(=O)C(=O)O HY-W006057R [0,1,0,0,0,0|1,0,1]=3 9 B7R0.16 CC(C)[C@H](N)[13C](=O)O HY-N0717S4 [0,1,0,0,0,0|1,0,2]=4 10 B7R0.16 CC(C)[C@H]([15NH2])C(=O)O HY-N0717S [0,1,0,0,0,0|1,0,2]=4 11 B7R0.16 CN(C)C(Cl)=[N+](C)C HY-W011556 [0,1,0,0,0,0|3,0,0]=4 12 B7R0.16 CN(C)C(F)=[N+](C)C HY-W011734 [0,1,0,0,0,0|3,0,0]=4 13 B7R0.16 [13CH3][13CH]([13CH3])[13C@H](N)[13C](=O)O HY-N0717S6 [0,1,0,0,0,0|1,0,2]=4 14 B7R1.2 O=C1CCC(=O)[15NH]1 HY-41877S [0,0,0,1,0,0|2,0,0]=3 15 B5R0.5 CC(N)[13C](=O)O HY-N2362S [0,0,0,0,1,0|2,0,1]=4 16 B5R0.5 C[13C@H]([15NH2])[13C](=O)O HY-N0229S15 [0,0,0,0,1,0|2,0,1]=4 17 B5R0.5 C[C@@H](N)C(=O)O HY-41700 [0,0,0,0,1,0|2,0,1]=4 18 B5R0.5 C[C@H](N)C(N)=O HY-75326 [0,0,0,0,1,0|2,0,1]=4 19 B5R0.5 C[C@H](N)[13C](=O)O HY-N0229S1 [0,0,0,0,1,0|2,0,1]=4 20 B5R0.5 C[C@H]([15NH2])C(=O)O HY-N0229S2 [0,0,0,0,1,0|2,0,1]=4 21 B5R0.5 O=C([O-])C(=O)[O-] HY-W140731 [0,0,0,0,1,0|3,0,0]=4 22 B5R0.5 O=[13C](O)[13C](=O)O HY-Y0262S1 [0,0,0,0,1,0|3,0,0]=4 23 B5R0.5 [13CH3]C(N)C(=O)O HY-N2362S1 [0,0,0,0,1,0|2,0,1]=4 24 B5R0.5 [13CH3][13C@H](N)C(=O)O HY-N0229S9 [0,0,0,0,1,0|2,0,1]=4 25 B5R0.5 [13CH3][13C@H](N)[13C](=O)O HY-N0229S8 [0,0,0,0,1,0|2,0,1]=4 26 B5R0.5 [13CH3][13C@H](O)[13C](=O)O HY-Y0479S [0,0,0,0,1,0|2,0,1]=4 27 B5R0.5 [13CH3][13C@H]([15NH2])[13C](=O)O HY-N0229S10 [0,0,0,0,1,0|2,0,1]=4 28 B5R0.5 [13CH3][C@H](N)C(=O)O HY-N0229S6 [0,0,0,0,1,0|2,0,1]=4 29 B7R0.6 CN(C)\C=C\[N+](=O)[O-] HY-20395 [0,0,0,0,0,1|3,0,0]=4 30 B7R0.6 C[S+](C)CCC(=O)O HY-W105506 [0,0,0,0,0,1|2,0,1]=4 31 B7R0.6 O=[13C](O)\C=C\[13C](=O)O HY-W015883S1 [0,0,0,0,0,1|3,0,0]=4 32 B4R0.1 C=CC(=O)O HY-W243303B [2,0,0,0,0,0|1,0,0]=3 33 B4R0.1 C=CC(=O)O HY-W243303M [2,0,0,0,0,0|1,0,0]=3 34 B4R0.1 C=CC(N)=O HY-W115727E [2,0,0,0,0,0|1,0,0]=3 35 B4R0.1 CC(=O)CN HY-W004850 [2,0,0,0,0,0|1,0,1]=4 36 B4R0.1 [13CH3][13CH2][13C](=O)O HY-B1773AS3 [2,0,0,0,0,0|1,0,1]=4 37 B4R0.1 [13CH3][13C](=O)O[Na] HY-W749209 [2,0,0,0,0,0|2,0,0]=4 38 B6R0.1 C\C=N\N(C)C=O HY-W762013 [1,1,0,0,0,0|2,0,0]=4 39 B6R0.3 C(C)=C(/C)C(=O)O HY-N6929 [1,1,0,0,0,0|1,0,0]=3 40 B6R0.3 CC(=O)C(=O)O[Na] HY-W015913 [1,1,0,0,0,0|2,0,0]=4 41 B6R0.3 CC(=O)C(=O)O[Na] HY-W015913R [1,1,0,0,0,0|2,0,0]=4 42 B6R0.3 CC(=O)[13C](=O)O[Na] HY-Y0781S3 [1,1,0,0,0,0|2,0,0]=4 43 B6R0.3 CCC(=O)C(C)=O HY-W012998R [1,1,0,0,0,0|0,0,1]=3 44 B6R0.3 C[13C](=O)C(=O)O[Na] HY-Y0781S [1,1,0,0,0,0|2,0,0]=4 45 B6R0.4 O=C(O)\C=C\CO HY-100982 [1,1,0,0,0,0|1,0,0]=3 46 B6R0.7 CC(C)(Br)C(=O)Br HY-Y0238 [0,1,0,0,1,0|1,0,1]=4 47 B8R0.2 [13CH3][13CH]([13CH3])[13C](=O)[13C](=O)O[Na] HY-W006057AS16 [0,2,0,0,0,0|1,0,1]=4 48 B8R1.50 CC1C(=O)CCC1=O HY-W012944 [0,1,0,1,0,0|1,0,1]=4