0 B8R0.2 CCC(C)C(N)C(=O)O HY-W1005647 [1,0,0,0,0,0|1,0,0]=2 1 B8R0.2 CC[C@@H](C)[C@@H](N)C(=O)O HY-I1070 [1,0,0,0,0,0|1,0,0]=2 2 B8R0.2 CC[C@@H](C)[C@H](N)C(=O)O HY-I1060 [1,0,0,0,0,0|1,0,0]=2 3 B8R0.2 CC[C@H](C)[C@H](N)C(=O)O HY-N0771R [1,0,0,0,0,0|1,0,0]=2 4 B8R0.8 C#CCCC(N)C(=O)O HY-W259668 [1,0,0,0,0,0|1,0,1]=3 5 B8R0.8 C#CCC[C@H](N)C(=O)O HY-140345A [1,0,0,0,0,0|1,0,1]=3 6 B8R0.8 CCCC[C@H](N)C(=O)O HY-Y0017R [1,0,0,0,0,0|1,0,0]=2 7 B8R0.8 NOCC[C@H](N)C(=O)O HY-129476 [1,0,0,0,0,0|1,0,0]=2 8 B8R0.8 N[13CH2][13CH2][13CH2][13C@H](N)[13C](=O)O HY-W017018S2 [1,0,0,0,0,0|0,0,0]=1 9 B8R0.8 [13CH3]SCC[C@H](N)C(=O)O HY-N0326S3 [1,0,0,0,0,0|2,0,0]=3 10 B8R0.8 [13CH3]S[13CH2][13CH2][13C@H](N)[13C](=O)O HY-N0326S5 [1,0,0,0,0,0|2,0,0]=3 11 B10R1.23 N[C@@H](C(=O)O)C1CCCC1 HY-33259 [0,0,0,1,0,0|2,0,0]=3 12 B10R1.23 [C@@H](N)(C(=O)O)C1CCCC1 HY-W008530 [0,0,0,1,0,0|2,0,0]=3 13 B10R1.34 O=C1O[C@H](CO)[C@@H](O)[C@H]1O HY-76691 [0,0,0,1,0,0|2,0,0]=3 14 B7R0.2 NC[C@@H](F)C[PH](=O)O HY-10061B [2,0,0,0,0,0|2,0,0]=4 15 B7R0.2 NC[C@H](O)CC(=O)O HY-W005749 [2,0,0,0,0,0|0,0,0]=2 16 B7R0.2 N[C@H](CO)CC(=O)O HY-W040432 [2,0,0,0,0,0|2,0,0]=4 17 B7R0.2 O=C([O-])C[C@H](O)CO HY-113304A [2,0,0,0,0,0|1,0,1]=4 18 B7R0.5 C=CC[C@H](N)C(=O)O HY-W012906 [2,0,0,0,0,0|0,0,2]=4 19 B7R0.5 COCC(N)C(=O)O HY-W012871 [2,0,0,0,0,0|1,0,0]=3 20 B7R0.5 N[C@H](CCS)C(=O)O HY-77801 [2,0,0,0,0,0|1,0,0]=3 21 B7R0.10 O=C[C@H](O)[C@H](O)[13CH2]O HY-116956S3 [2,0,0,0,0,0|2,0,0]=4 22 B7R0.16 CC(C)[C@H](N)[13C](=O)O HY-N0717S4 [2,0,0,0,0,0|1,0,0]=3 23 B7R0.16 CC(C)[C@H]([15NH2])C(=O)O HY-N0717S [2,0,0,0,0,0|1,0,0]=3 24 B7R0.16 [13CH3][13C@@H](O)[13C@H](N)[13C](=O)O HY-N0658S6 [2,0,0,0,0,0|0,0,0]=2 25 B7R0.16 [13CH3][13C@@H](O)[13C@H]([15NH2])[13C](=O)O HY-N0658S3 [2,0,0,0,0,0|0,0,0]=2 26 B7R0.16 [13CH3][13CH]([13CH3])[13C@H](N)[13C](=O)O HY-N0717S6 [2,0,0,0,0,0|1,0,0]=3 27 B7R0.4 NCCNCC(=O)O HY-W012883 [2,0,0,0,0,0|1,0,0]=3 28 B7R0.4 O=C(O)COCCO HY-W591338A [2,0,0,0,0,0|2,0,0]=4 29 B7R0.4 O=C(O)COCCO HY-W591338B [2,0,0,0,0,0|2,0,0]=4 30 B7R0.4 O=C(O)COCCS HY-140728 [2,0,0,0,0,0|2,0,0]=4 31 B9R0.27 O=C(CO)[C@@H](O)[C@@H](O)CO HY-121305A [1,1,0,0,0,0|2,0,0]=4 32 B9R0.27 O=C(CO)[C@@H](O)[C@@H](O)CO HY-121305B [1,1,0,0,0,0|2,0,0]=4 33 B9R0.27 O=C(CO)[C@H](O)[C@@H](O)CO HY-113317 [1,1,0,0,0,0|2,0,0]=4 34 B9R0.27 [C@@H](O)(C(=O)CO)[C@H](O)CO HY-W010256 [1,1,0,0,0,0|2,0,0]=4 35 B9R0.79 N[C@H](C(=O)O)[C@H](O)C(=O)O HY-100801A [1,1,0,0,0,0|1,0,1]=4 36 B9R0.14 CCC[C@@H](CBr)CC(=O)O HY-Z6843 [1,1,0,0,0,0|2,0,0]=4 37 B9R0.53 O=C(O)CC(O)CC(=O)O HY-113411 [1,1,0,0,0,0|1,0,1]=4 38 B9R0.7 CS(=O)CC[C@@H](N)C(=O)O HY-129770A [1,1,0,0,0,0|2,0,0]=4 39 B9R0.7 NC(=O)CC[13C@H](N)[13C](=O)O HY-N0390S10 [1,1,0,0,0,0|0,0,1]=3 40 B9R0.7 NC(=O)CC[C@H](N)[13C](=O)O HY-N0390S5 [1,1,0,0,0,0|0,0,1]=3 41 B9R0.7 NC(=O)NCC(N)C(=O)O HY-N12109 [1,1,0,0,0,0|1,0,1]=4 42 B9R0.7 N[13C](=O)[13CH2][13CH2][13C@H](N)[13C](=O)O HY-N0390S1 [1,1,0,0,0,0|0,0,1]=3 43 B9R0.7 N[C@@H](CCC([15NH2])=O)C(=O)O HY-N0390S9 [1,1,0,0,0,0|0,0,1]=3 44 B9R0.7 [15NH2]C(=O)CC[C@H]([15NH2])C(=O)O HY-N0390S8 [1,1,0,0,0,0|0,0,1]=3 45 B9R0.7 [15NH2][13C@@H]([13CH2][13CH2][13C](=O)O)[13C](=O)O HY-14608S3 [1,1,0,0,0,0|1,0,1]=4 46 B9R0.7 [15NH2][13C](=O)[13CH2][13CH2][13C@H]([15NH2])[13C](=O)O HY-N0390S6 [1,1,0,0,0,0|0,0,1]=3 47 B9R0.47 CCCCCC(C)C(=O)O HY-W015664 [1,1,0,0,0,0|2,0,0]=4 48 B9R0.47 CCSCCC(N)C(=O)O HY-W017202 [1,1,0,0,0,0|1,0,0]=3 49 B9R0.47 CCSCC[C@H](N)C(=O)O HY-W017200 [1,1,0,0,0,0|1,0,0]=3 50 B9R0.47 CC[Se]CCC(N)C(=O)O HY-W585825 [1,1,0,0,0,0|1,0,0]=3 51 B9R0.47 CNCCC[C@H](N)C(C)=O HY-126436A [1,1,0,0,0,0|1,0,0]=3 52 B9R0.47 NCCCC[C@@H](N)C(=O)O HY-Y1804 [1,1,0,0,0,0|0,0,0]=2 53 B9R0.47 NCCCC[C@H](N)C(=O)O HY-N0469R [1,1,0,0,0,0|0,0,0]=2 54 B9R0.47 NCCCC[C@H](N)[13C](=O)O HY-N0470S2 [1,1,0,0,0,0|0,0,0]=2 55 B9R0.47 NCCCC[C@H]([15NH2])C(=O)O HY-W009762S7 [1,1,0,0,0,0|0,0,0]=2 56 B9R0.47 [15NH2]CCCC[C@H]([15NH2])C(=O)O HY-N0470S [1,1,0,0,0,0|0,0,0]=2 57 B9R0.47 [C@H](N)(CCCCN)C(=O)O HY-W014606 [1,1,0,0,0,0|0,0,0]=2 58 B9R0.47 [N-]=[N+]=NCC[C@@H](N)C(=O)O HY-151723 [1,1,0,0,0,0|1,0,1]=4 59 B11R0.66 N[C@@H]([C@H](O)[C@H](O)CO)[C@@H](O)C=O HY-112176 [0,2,0,0,0,0|1,0,1]=4 60 B11R0.66 O=C(CO)[C@@H](O)[C@H](O)[C@H](O)[13CH2]O HY-N7092S7 [0,2,0,0,0,0|2,0,0]=4 61 B11R0.66 O=C(CO)[C@H](O)[C@@H](O)[C@@H](O)CO HY-N7092A [0,2,0,0,0,0|2,0,0]=4 62 B11R0.66 O=C(CO)[C@H](O)[C@H](O)[C@@H](O)CO HY-W145570 [0,2,0,0,0,0|2,0,0]=4 63 B11R0.66 O=C([13CH2]O)[C@@H](O)[C@H](O)[C@H](O)CO HY-N7092S1 [0,2,0,0,0,0|2,0,0]=4 64 B11R0.66 O=[13C]([13CH2]O)[13C@@H](O)[13C@H](O)[13C@H](O)[13CH2]O HY-N7092S [0,2,0,0,0,0|2,0,0]=4 65 B9R1.6 O=C(O)C1CCCCN1 HY-Y0669 [1,0,0,1,0,0|1,0,0]=3 66 B9R1.163 C[C@@]1(C(=O)O)CCCN1 HY-76962 [1,0,0,1,0,0|1,0,0]=3 67 B11R1.35 NC(CC1CCCC1)C(=O)O HY-W102709 [0,0,0,1,0,1|2,0,0]=4 68 B11R1.314 [C@@H]1([C@H](N)C(=O)O)CC(Cl)=NO1 HY-W016586A [0,1,0,1,0,0|0,0,2]=4 69 B11R1.36 NC(C(=O)O)C1CCOCC1 HY-20838 [0,1,0,1,0,0|2,0,0]=4 70 B11R1.36 N[C@@H](C(=O)O)C1CCOCC1 HY-20838A [0,1,0,1,0,0|2,0,0]=4 71 B11R1.31 COC(=O)[C@@H](N)C1CCCC1 HY-33466 [0,1,0,1,0,0|2,0,0]=4