0 B5R0.1 C\C=C\C(C)=O HY-34748 [0,0,0,0,0,0|2,0,2]=4 1 B4R0.1 CC(=O)CN HY-W004850 [1,0,0,0,0,0|2,0,1]=4 2 B4R0.1 C[C@H](N)CO HY-Y0837 [1,0,0,0,0,0|1,0,1]=3 3 B4R0.1 C[C@H](O)CO HY-79334 [1,0,0,0,0,0|1,0,1]=3 4 B4R0.2 CCCNC HY-W250110E [1,0,0,0,0,0|2,0,0]=3 5 B4R0.2 CCCNC HY-W250110I [1,0,0,0,0,0|2,0,0]=3 6 B4R0.2 O=COO[Na] HY-ER013B [1,0,0,0,0,0|3,0,0]=4 7 B4R0.2 [Li]OOC=O HY-Y0292 [1,0,0,0,0,0|3,0,0]=4 8 B6R0.2 CC(=O)CC(=O)O HY-112540 [0,1,0,0,0,0|1,0,1]=3 9 B6R0.2 CC(C)=CC(=O)O HY-W010611 [0,1,0,0,0,0|0,0,2]=3 10 B6R0.2 CC(C)CC(=O)O HY-W012980R [0,1,0,0,0,0|0,0,0]=1 11 B6R0.2 CC(C)NC(C)C HY-B2210 [0,1,0,0,0,0|2,0,1]=4 12 B6R0.3 CC(C)[C@@H](N)CO HY-30167 [0,1,0,0,0,0|0,0,2]=3 13 B6R0.5 C[N+](C)(C)[13CH2][13CH2]O HY-B1337S5 [0,1,0,0,0,0|1,0,2]=4 14 B6R1.2 [C@H]1(F)CCNC1 HY-W004695 [0,0,0,1,0,0|2,0,1]=4 15 B3R0.1 NCCS HY-77591R [2,0,0,0,0,0|1,1,0]=4 16 B3R0.1 N[13CH2][13CH2]O HY-W035903S [2,0,0,0,0,0|1,0,1]=4 17 B3R0.1 O=CO[Na] HY-W088065 [2,0,0,0,0,0|2,0,0]=4 18 B3R0.1 O=[13CH]O[Na] HY-W088065S [2,0,0,0,0,0|2,0,0]=4 19 B3R0.1 OCCO HY-Y0873 [2,0,0,0,0,0|1,0,1]=4 20 B3R0.1 OCCO HY-Y0873A3 [2,0,0,0,0,0|1,0,1]=4 21 B3R0.1 [13CH](=O)[13CH2]O HY-W779008 [2,0,0,0,0,0|1,0,0]=3 22 B3R0.2 CC(=O)O HY-P0119A [2,0,0,0,0,0|1,0,1]=4 23 B3R0.2 CC([15NH2])=O HY-Y0946S [2,0,0,0,0,0|1,0,1]=4 24 B3R0.2 CS(C)=O HY-Y0320 [2,0,0,0,0,0|1,0,0]=3 25 B3R0.2 CS(C)=O HY-Y0320C [2,0,0,0,0,0|1,0,0]=3 26 B3R0.2 CS(C)=O HY-Y0320D [2,0,0,0,0,0|1,0,0]=3 27 B5R0.3 CCC(O)CC HY-W087988 [1,1,0,0,0,0|1,0,1]=4 28 B5R0.3 CC[C@H](C)CO HY-W093104 [1,1,0,0,0,0|0,0,1]=3 29 B5R0.3 OCC(Cl)CO HY-W585827 [1,1,0,0,0,0|1,0,1]=4 30 B5R0.3 OCC(O)CS HY-W010572 [1,1,0,0,0,0|1,0,1]=4 31 B5R0.3 OC[13CH](O)CO HY-B1659S2 [1,1,0,0,0,0|1,0,1]=4 32 B5R0.3 O[13CH2]C(O)[13CH2]O HY-B1659S4 [1,1,0,0,0,0|1,0,1]=4 33 B5R0.3 O[13CH2][13CH](O)[13CH2]O HY-B1659S5 [1,1,0,0,0,0|1,0,1]=4 34 B5R0.5 CC(N)[13C](=O)O HY-N2362S [1,1,0,0,0,0|1,0,0]=3 35 B5R0.5 C[13C@H]([15NH2])[13C](=O)O HY-N0229S15 [1,1,0,0,0,0|1,0,0]=3 36 B5R0.5 C[C@@H](N)C(=O)O HY-41700 [1,1,0,0,0,0|1,0,0]=3 37 B5R0.5 C[C@H](N)C(N)=O HY-75326 [1,1,0,0,0,0|1,0,0]=3 38 B5R0.5 C[C@H](N)[13C](=O)O HY-N0229S1 [1,1,0,0,0,0|1,0,0]=3 39 B5R0.5 C[C@H]([15NH2])C(=O)O HY-N0229S2 [1,1,0,0,0,0|1,0,0]=3 40 B5R0.5 O=C(O)C(I)I HY-133659 [1,1,0,0,0,0|2,0,0]=4 41 B5R0.5 [13CH3]C(N)C(=O)O HY-N2362S1 [1,1,0,0,0,0|1,0,0]=3 42 B5R0.5 [13CH3][13C@H](N)C(=O)O HY-N0229S9 [1,1,0,0,0,0|1,0,0]=3 43 B5R0.5 [13CH3][13C@H](N)[13C](=O)O HY-N0229S8 [1,1,0,0,0,0|1,0,0]=3 44 B5R0.5 [13CH3][13C@H](O)[13C](=O)O HY-Y0479S [1,1,0,0,0,0|1,0,0]=3 45 B5R0.5 [13CH3][13C@H]([15NH2])[13C](=O)O HY-N0229S10 [1,1,0,0,0,0|1,0,0]=3 46 B5R0.5 [13CH3][C@H](N)C(=O)O HY-N0229S6 [1,1,0,0,0,0|1,0,0]=3 47 B5R0.2 C=CCCCO HY-W010639 [1,1,0,0,0,0|1,0,0]=3 48 B7R0.2 CC(C)C[C@H](N)CO HY-W015876 [0,2,0,0,0,0|0,0,2]=4 49 B7R0.2 NC[C@@H](F)C[PH](=O)O HY-10061B [0,2,0,0,0,0|2,0,0]=4 50 B7R0.2 NC[C@H](O)CC(=O)O HY-W005749 [0,2,0,0,0,0|1,0,0]=3 51 B7R0.2 N[C@H](CO)CC(=O)O HY-W040432 [0,2,0,0,0,0|1,0,0]=3 52 B7R0.2 O=C([O-])C[C@H](O)CO HY-113304A [0,2,0,0,0,0|1,0,0]=3 53 B7R0.10 O=C[C@H](O)[C@H](O)[13CH2]O HY-116956S3 [0,2,0,0,0,0|1,0,0]=3 54 B7R0.9 CC(C)(O)CC(=O)O HY-113409 [0,2,0,0,0,0|0,0,0]=2 55 B7R0.9 C[N+](C)(C)CC(=O)[O-] HY-B0710R [0,2,0,0,0,0|1,0,0]=3 56 B7R0.16 CC(C)C(=O)C(=O)O HY-W006057R [0,2,0,0,0,0|0,0,1]=3 57 B7R0.16 CC(C)[C@H](N)[13C](=O)O HY-N0717S4 [0,2,0,0,0,0|0,0,0]=2 58 B7R0.16 CC(C)[C@H]([15NH2])C(=O)O HY-N0717S [0,2,0,0,0,0|0,0,0]=2 59 B7R0.16 [13CH3][13C@@H](O)[13C@H](N)[13C](=O)O HY-N0658S6 [0,2,0,0,0,0|1,0,0]=3 60 B7R0.16 [13CH3][13C@@H](O)[13C@H]([15NH2])[13C](=O)O HY-N0658S3 [0,2,0,0,0,0|1,0,0]=3 61 B7R0.16 [13CH3][13CH]([13CH3])[13C@H](N)[13C](=O)O HY-N0717S6 [0,2,0,0,0,0|0,0,0]=2 62 B7R0.6 CN(C)\C=C\[N+](=O)[O-] HY-20395 [0,2,0,0,0,0|1,0,1]=4 63 B7R0.6 C[S+](C)CCC(=O)O HY-W105506 [0,2,0,0,0,0|1,0,0]=3 64 B5R1.2 C[C@H]1CCN1 HY-35279 [1,0,0,1,0,0|1,0,1]=4