0 B8R0.2 C#C[C@@H](O)[C@H](N)C(=O)O HY-164745 [0,0,0,0,0,0|1,0,2]=3 1 B8R0.2 CC[C@H](C)[C@H](N)[13C](=O)O HY-N0771S4 [0,0,0,0,0,0|0,0,0]=0 2 B8R0.2 [13CH3][13CH2][13C@H]([13CH3])[13C@H](N)[13C](=O)O HY-N0771S [0,0,0,0,0,0|0,0,0]=0 3 B8R0.2 [13CH3][13CH2][13C@H]([13CH3])[13C@H]([15NH2])[13C](=O)O HY-N0771S9 [0,0,0,0,0,0|0,0,0]=0 4 B7R0.2 NC[C@@H](O)CC(=O)O HY-W050122 [1,0,0,0,0,0|2,0,0]=3 5 B7R0.5 C#CC[C@H](N)C(=O)O HY-W006064 [1,0,0,0,0,0|0,0,2]=3 6 B7R0.5 C=CCC(N)C(=O)O HY-W023493 [1,0,0,0,0,0|0,0,2]=3 7 B7R0.10 O=C[C@@H](O)[C@H](O)[13CH2]O HY-W012864S2 [1,0,0,0,0,0|3,0,0]=4 8 B7R0.16 CC(C)[C@H](O)C(=O)O HY-30217 [1,0,0,0,0,0|1,0,0]=2 9 B7R0.16 [13CH3][13CH]([13CH3])[13C@H]([15NH2])[13C](=O)O HY-N0717S1 [1,0,0,0,0,0|0,0,0]=1 10 B9R0.27 O=C(O[K])[C@H](O)[C@H](O)CO HY-113048A [0,1,0,0,0,0|3,0,0]=4 11 B9R0.27 O=C([13CH2]O)[C@@H](O)[C@H](O)CO HY-W010256S [0,1,0,0,0,0|3,0,0]=4 12 B9R0.27 O=[13C](CO)[C@@H](O)[C@H](O)CO HY-W010256S1 [0,1,0,0,0,0|3,0,0]=4 13 B9R0.27 [13C@@H](O)([13C](=O)[13CH2]O)[13C@H](O)[13CH2]O HY-W010256S3 [0,1,0,0,0,0|3,0,0]=4 14 B9R0.79 N[C@H](C(=O)O)[C@H](O)C(=O)O HY-100801 [0,1,0,0,0,0|2,0,1]=4 15 B9R1.37 [13CH]1([13CH3])OC(=O)C(O)=C1C HY-W779534 [0,0,0,1,0,0|1,0,2]=4 16 B9R0.23 COC(=O)[C@@H](N)CC(=O)O HY-W017499 [0,0,0,0,0,1|2,0,1]=4 17 B6R0.4 N[13CH2][13CH2][13CH2][13C](=O)O HY-N0067S3 [2,0,0,0,0,0|1,0,0]=3 18 B6R0.4 O=CCCC(=O)O HY-104071 [2,0,0,0,0,0|1,0,1]=4 19 B6R0.3 NC(CS)C(=O)O HY-W012850 [2,0,0,0,0,0|1,0,0]=3 20 B6R0.3 NCC(O)C(=O)O HY-W012966 [2,0,0,0,0,0|2,0,0]=4 21 B6R0.3 N[13C@@H]([13CH2]S)[13C](=O)O HY-Y0337S4 [2,0,0,0,0,0|1,0,0]=3 22 B6R0.3 N[C@@H](CO)C(=O)O HY-W142089 [2,0,0,0,0,0|1,0,0]=3 23 B6R0.3 N[C@@H](CS)[13C](=O)O HY-Y0337S3 [2,0,0,0,0,0|1,0,0]=3 24 B6R0.3 N[C@@H]([13CH2]S)C(=O)O HY-Y0337S2 [2,0,0,0,0,0|1,0,0]=3 25 B6R0.3 [15NH2][13C@@H]([13CH2]O)[13C](=O)O HY-N0650S5 [2,0,0,0,0,0|1,0,0]=3 26 B6R0.3 [15NH2][13C@@H]([13CH2]S)[13C](=O)O HY-Y0337S [2,0,0,0,0,0|1,0,0]=3 27 B8R0.34 CC(C)(CN)CC(=O)O HY-41317 [1,1,0,0,0,0|1,0,0]=3 28 B8R0.8 C[34S]CC[C@H](N)C(=O)O HY-112019 [1,1,0,0,0,0|0,0,0]=2 29 B8R0.8 [13CH3]S[13CH2][13CH2][13C@H]([15NH2])[13C](=O)O HY-N0326S6 [1,1,0,0,0,0|0,0,0]=2 30 B8R0.8 [15NH2]CCC[C@H]([15NH2])C(=O)O HY-W017018S5 [1,1,0,0,0,0|0,0,0]=2 31 B8R0.27 [2H]C([2H])(O)[C@H](N)C(=O)O HY-N0650S7 [1,1,0,0,0,0|2,0,0]=4 32 B8R0.37 CC(C)[C@](C)(N)C(=O)O HY-W012707 [1,1,0,0,0,0|0,0,0]=2 33 B10R0.30 CCCC(C(=O)O)C(O)CC HY-W400421 [0,2,0,0,0,0|2,0,0]=4 34 B8R1.7 O=[13C](O)[13C@@H]1[13CH2][13CH2][13CH2][15NH]1 HY-Y0252S4 [1,0,0,1,0,0|0,0,0]=2 35 B10R1.204 N[C@H](CC1CCC1)C(=O)O HY-20861 [0,0,0,1,0,1|0,0,0]=2 36 B10R0.82 NC(CF)CCC(N)C(=O)O HY-154021A [0,0,0,0,0,2|2,0,0]=4