0 B8R1.7 O=C(O)[C@@H]1CCC[15NH]1 HY-Y0252S2 [1,0,0,0,0,0|0,0,0]=1 1 B8R1.7 O=[13C](O)[13C@@H]1[13CH2][13CH2][13CH2]N1 HY-Y0252S [1,0,0,0,0,0|0,0,0]=1 2 B10R1.14 COC(=O)[C@@H]1C[C@H](O)CN1 HY-W016429 [0,1,0,0,0,0|0,0,0]=1 3 B10R1.14 COC(=O)[C@H]1C[C@@H](O)CN1 HY-76105 [0,1,0,0,0,0|0,0,0]=1 4 B10R1.14 COC(=O)[C@H]1C[C@H](O)CN1 HY-W006629 [0,1,0,0,0,0|0,0,0]=1 5 B8R0.8 CCCC[C@H](N)C(=O)O HY-Y0017R [0,0,1,0,0,0|3,0,0]=4 6 B8R0.8 N[13CH2][13CH2][13CH2][13C@H](N)[13C](=O)O HY-W017018S2 [0,0,1,0,0,0|3,0,0]=4 7 B8R0.9 C=CC(N)CCC(=O)O HY-15399 [0,0,1,0,0,0|2,0,1]=4 8 B8R0.9 NCC(=O)CCC(=O)O HY-W000450 [0,0,1,0,0,0|0,0,2]=3 9 B8R0.9 NCC(=O)NCC(=O)O HY-D0889 [0,0,1,0,0,0|1,0,2]=4 10 B8R0.23 CC(C)C[C@@H](N)C(N)=O HY-W111211 [0,0,1,0,0,0|2,0,0]=3 11 B8R0.23 CC(C)C[C@@H](O)C(=O)O HY-30216 [0,0,1,0,0,0|2,0,0]=3 12 B8R0.23 CC(C)C[C@H]([15NH2])C(=O)O HY-N0486S3 [0,0,1,0,0,0|1,0,0]=2 13 B8R0.23 NC(=O)C[C@@H](N)C(=O)O HY-W010378R [0,0,1,0,0,0|1,0,2]=4 14 B8R0.23 NC(=O)C[C@@H](N)C(=O)O HY-W017444 [0,0,1,0,0,0|1,0,2]=4 15 B8R0.23 NC(=O)C[C@H](N)C(=O)O HY-N0667 [0,0,1,0,0,0|1,0,2]=4 16 B8R0.23 N[C@@H](CC(=O)O)C(=O)O HY-N0666 [0,0,1,0,0,0|1,0,1]=3 17 B8R0.23 N[C@@H](CC([15NH2])=O)C(=O)O HY-W017443S1 [0,0,1,0,0,0|1,0,2]=4 18 B8R0.23 N[C@@H](C[13C](=O)O)[13C](=O)O HY-N0666S6 [0,0,1,0,0,0|1,0,1]=3 19 B8R0.23 N[C@H](CC(=O)O)C(=O)O HY-42068 [0,0,1,0,0,0|1,0,1]=3 20 B8R0.23 O=C(O)C[C@H](O)C(=O)O HY-Y1069R [0,0,1,0,0,0|2,0,1]=4 21 B8R0.23 O=[13C](O)[13CH2][13C@H](O)[13C](=O)O HY-Y1069S3 [0,0,1,0,0,0|2,0,1]=4 22 B8R0.23 [13CH2]([13C](=O)O)[13C@H](N)[13C](=O)O HY-N0666S4 [0,0,1,0,0,0|1,0,1]=3 23 B8R0.23 [13CH3][13CH]([13CH3])[13CH2][13C@H](N)[13C](=O)O HY-N0486S2 [0,0,1,0,0,0|1,0,0]=2 24 B8R0.23 [15NH2][C@@H](CC(=O)O)C(=O)O HY-N0666S3 [0,0,1,0,0,0|1,0,1]=3 25 B7R0.4 NCCNCC(=O)O HY-W012883 [1,0,1,0,0,0|1,0,0]=3 26 B7R0.4 O=C(O)COCCO HY-W591338A [1,0,1,0,0,0|1,0,0]=3 27 B7R0.4 O=C(O)COCCO HY-W591338B [1,0,1,0,0,0|1,0,0]=3 28 B7R0.4 O=C(O)COCCS HY-140728 [1,0,1,0,0,0|1,1,0]=4 29 B7R0.5 C=CC[C@H](N)C(=O)O HY-W012906 [1,0,1,0,0,0|0,0,2]=4 30 B7R0.5 COCC(N)C(=O)O HY-W012871 [1,0,1,0,0,0|1,0,0]=3 31 B7R0.5 N[C@H](CCS)C(=O)O HY-77801 [1,0,1,0,0,0|0,1,0]=3 32 B7R0.6 C[S+](C)CCC(=O)O HY-W105506 [1,0,1,0,0,0|2,0,0]=4 33 B7R0.6 O=[13C](O)[13CH2][13CH2][13C](=O)O HY-N0420S2 [1,0,1,0,0,0|1,0,1]=4 34 B7R0.2 CC(C)C[C@H](N)CO HY-W015876 [1,0,1,0,0,0|1,0,1]=4 35 B7R1.1 O=CN1CCCC1 HY-W102648 [2,0,0,0,0,0|2,0,0]=4 36 B9R0.42 C[C@H](NC(=O)CN)C(=O)O HY-W141910 [0,1,1,0,0,0|1,0,1]=4 37 B9R0.47 CCCCCC(C)C(=O)O HY-W015664 [0,1,1,0,0,0|2,0,0]=4 38 B9R0.39 CN[C@@H](CC(C)C)C(=O)O HY-W128028 [0,1,1,0,0,0|1,0,0]=3 39 B9R0.39 [C@@H](CC(C)C)(NC)C(=O)O HY-W008140 [0,1,1,0,0,0|1,0,0]=3 40 B9R0.57 N[C@@H](CS(=O)(=O)O)C(=O)O HY-124009 [0,1,1,0,0,0|2,0,0]=4 41 B9R0.79 N[C@H](C(=O)O)[C@H](O)C(=O)O HY-100801A [0,1,1,0,0,0|1,0,1]=4 42 B9R1.11 O=C(O[Na])C1=NCCC1 HY-138354A [1,1,0,0,0,0|0,0,2]=4 43 B9R1.163 C[C@@]1(C(=O)O)CCCN1 HY-76962 [1,1,0,0,0,0|0,0,0]=2 44 B9R1.6 O=C(O)C1CCCCN1 HY-Y0669 [0,0,1,1,0,0|1,0,0]=3 45 B7R0.16 CC(C)[C@H](N)[13C](=O)O HY-N0717S4 [0,0,1,0,1,0|1,0,0]=3 46 B7R0.16 CC(C)[C@H]([15NH2])C(=O)O HY-N0717S [0,0,1,0,1,0|1,0,0]=3 47 B7R0.16 [13CH3][13C@@H](O)[13C@H](N)[13C](=O)O HY-N0658S6 [0,0,1,0,1,0|0,0,0]=2 48 B7R0.16 [13CH3][13C@@H](O)[13C@H]([15NH2])[13C](=O)O HY-N0658S3 [0,0,1,0,1,0|0,0,0]=2 49 B7R0.16 [13CH3][13CH]([13CH3])[13C@H](N)[13C](=O)O HY-N0717S6 [0,0,1,0,1,0|1,0,0]=3