0  B8R1.7  O=[13C](O)[13C@@H]1[13CH2][13CH2][13CH2][15NH]1 HY-Y0252S4 [0,0,0,0,0,0|0,0,0]=0
1  B9R1.35  O=[13C]1[13CH2][13CH2][13C@@H]([13C](=O)O)N1 HY-76082S1 [0,1,0,0,0,0|0,0,1]=2
2  B9R1.35  [15NH2][13C]1=[15N]C(C(=O)O)CS1 HY-W051624S [0,1,0,0,0,0|1,0,2]=4
3  B7R0.5  C#CC[C@H](N)C(=O)O HY-W006064 [0,0,1,0,0,0|0,0,2]=3
4  B7R0.5  C=CCC(N)C(=O)O HY-W023493 [0,0,1,0,0,0|0,0,2]=3
5  B7R1.18  O=C(O)C1CCN1 HY-75308 [0,0,0,0,1,0|0,0,0]=1
6  B6R0.4  N[13CH2][13CH2][13CH2][13C](=O)O HY-N0067S3 [1,0,1,0,0,0|0,0,0]=2
7  B6R0.4  O=CCCC(=O)O HY-104071 [1,0,1,0,0,0|1,0,1]=4
8  B6R0.3  NC(CS)C(=O)O HY-W012850 [1,0,1,0,0,0|1,0,0]=3
9  B6R0.3  NCC(O)C(=O)O HY-W012966 [1,0,1,0,0,0|2,0,0]=4
10  B6R0.3  N[13C@@H]([13CH2]S)[13C](=O)O HY-Y0337S4 [1,0,1,0,0,0|1,0,0]=3
11  B6R0.3  N[C@@H](CO)C(=O)O HY-W142089 [1,0,1,0,0,0|1,0,0]=3
12  B6R0.3  N[C@@H](CS)[13C](=O)O HY-Y0337S3 [1,0,1,0,0,0|1,0,0]=3
13  B6R0.3  N[C@@H]([13CH2]S)C(=O)O HY-Y0337S2 [1,0,1,0,0,0|1,0,0]=3
14  B6R0.3  [15NH2][13C@@H]([13CH2]O)[13C](=O)O HY-N0650S5 [1,0,1,0,0,0|1,0,0]=3
15  B6R0.3  [15NH2][13C@@H]([13CH2]S)[13C](=O)O HY-Y0337S [1,0,1,0,0,0|1,0,0]=3
16  B8R0.7  O=C(O)CCOCCS HY-W190877 [0,1,1,0,0,0|1,0,0]=3
17  B8R0.8  C[34S]CC[C@H](N)C(=O)O HY-112019 [0,1,1,0,0,0|2,0,0]=4
18  B8R0.8  [13CH3]S[13CH2][13CH2][13C@H]([15NH2])[13C](=O)O HY-N0326S6 [0,1,1,0,0,0|2,0,0]=4
19  B8R0.8  [15NH2]CCC[C@H]([15NH2])C(=O)O HY-W017018S5 [0,1,1,0,0,0|0,0,0]=2
20  B8R0.9  NC[13C](=O)CCC(=O)O HY-N0305S3 [0,1,1,0,0,0|0,0,1]=3
21  B8R0.9  [15NH2][13CH2][13C](=O)CCC(=O)O HY-W749251 [0,1,1,0,0,0|0,0,1]=3
22  B8R0.2  C#C[C@@H](O)[C@H](N)C(=O)O HY-164745 [0,1,1,0,0,0|0,0,2]=4
23  B8R0.2  CC[C@H](C)[C@H](N)[13C](=O)O HY-N0771S4 [0,1,1,0,0,0|0,0,0]=2
24  B8R0.2  [13CH3][13CH2][13C@H]([13CH3])[13C@H](N)[13C](=O)O HY-N0771S [0,1,1,0,0,0|0,0,0]=2
25  B8R0.2  [13CH3][13CH2][13C@H]([13CH3])[13C@H]([15NH2])[13C](=O)O HY-N0771S9 [0,1,1,0,0,0|0,0,0]=2
26  B8R0.23  N[C@@H](CC(=O)O)[13C](=O)O HY-N0666S [0,1,1,0,0,0|1,0,1]=4
27  B8R0.23  [13CH3][13CH]([13CH3])[13CH2][13C@H]([15NH2])[13C](=O)O HY-N0486S8 [0,1,1,0,0,0|0,0,0]=2
28  B8R0.23  [15NH2]C(CC(=O)O)[13C](=O)O HY-W015824S5 [0,1,1,0,0,0|1,0,1]=4
29  B8R0.23  [15NH2][13C](=O)[13CH2][13C@H]([15NH2])[13C](=O)O HY-W017443S [0,1,1,0,0,0|1,0,1]=4
30  B10R2.2  [C@H]12CC=C[C@H]1CC(=O)O2 HY-43001 [0,0,0,1,0,1|1,0,1]=4