0 B6R0.2 CC(C)CC(C)N HY-W114255 [1,0,0,0,0,0|2,0,1]=4 1 B6R0.2 C[C@@H](O)CC(=O)O HY-W051723R [1,0,0,0,0,0|1,0,0]=2 2 B8R0.2 CCC(O)C(N)C(=O)O HY-W142133 [0,1,0,0,0,0|1,0,0]=2 3 B8R0.2 CC[C@@H](C)[C@H](N)C(=O)O HY-I1060R [0,1,0,0,0,0|0,0,0]=1 4 B8R0.5 CCOC(=O)CC(=O)O HY-Y1031R [0,1,0,0,0,0|1,0,1]=3 5 B8R0.5 CCOC(=O)CC(C)=O HY-Y1093R [0,1,0,0,0,0|2,0,1]=4 6 B8R0.5 CCOC(=O)C[13C](C)=O HY-Y1093S3 [0,1,0,0,0,0|2,0,1]=4 7 B8R0.19 O=C(C[C@H](O)CO)O[Na] HY-W671225 [0,1,0,0,0,0|2,0,0]=3 8 B8R0.23 NC(CC(=O)O)C(=O)O HY-W015824R [0,1,0,0,0,0|2,0,1]=4 9 B8R0.23 N[C@@H]([13CH2]C(=O)O)C(=O)O HY-N0666S10 [0,1,0,0,0,0|2,0,1]=4 10 B8R0.23 N[C@H](CC(=O)O)C(=O)O HY-42068R [0,1,0,0,0,0|2,0,1]=4 11 B6R0.3 CCC(Br)C(=O)O HY-W015333R [0,0,0,0,1,0|1,0,0]=2 12 B6R0.3 CCC(N)C(=O)O HY-W010590R [0,0,0,0,1,0|1,0,0]=2 13 B6R0.3 C[C@@H](CN)C(=O)O HY-113380R [0,0,0,0,1,0|1,0,0]=2 14 B6R0.3 C\C=C(/C)C(=O)O HY-W012999R [0,0,0,0,1,0|0,0,2]=3 15 B6R0.3 N[13C@@H](CO)C(=O)O HY-N0650S4 [0,0,0,0,1,0|2,0,0]=3 16 B6R0.3 N[C@H](CS)C(=O)O HY-W018555R [0,0,0,0,1,0|2,0,0]=3 17 B8R0.9 C=CC(N)CCC(=O)O HY-15399R [0,0,0,0,0,1|1,0,2]=4 18 B5R0.3 O=C[C@H](O)CO HY-W008507 [2,0,0,0,0,0|2,0,0]=4 19 B5R0.3 O=[13CH][13CH](O)[13CH2]O HY-128748S4 [2,0,0,0,0,0|2,0,0]=4 20 B7R0.9 CC(=O)CC(C)(C)N HY-N3739 [1,1,0,0,0,0|1,0,0]=3 21 B7R0.9 C[As+](C)(C)CC(=O)[O-] HY-W795031 [1,1,0,0,0,0|1,0,1]=4 22 B7R0.16 CC(C)C(O)C(=O)O HY-W008150R [1,1,0,0,0,0|0,0,0]=2 23 B7R0.16 CC(C)[C@H]([15NH2])[13C](=O)O HY-N0717S7 [1,1,0,0,0,0|0,0,0]=2 24 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O HY-N0658AR [1,1,0,0,0,0|1,0,0]=3 25 B7R0.4 NCCCCC(=O)O HY-W015878R [1,1,0,0,0,0|0,0,0]=2 26 B7R0.6 O=C(O)[13CH2][13CH2]C(=O)O HY-N0420S4 [1,1,0,0,0,0|1,0,1]=4 27 B7R0.13 CC(N)(CO)C(=O)O HY-W012873 [0,1,0,0,1,0|1,0,0]=3 28 B7R0.15 CCC(CC)C(=O)O HY-W004154R [0,1,0,0,1,0|0,0,0]=2 29 B9R0.7 CC(CCC(=O)O)C(=O)O HY-W017524R [0,1,0,0,0,1|1,0,1]=4 30 B9R0.28 [2H][C@@](N)(C(=O)O)[C@@H](C)CC HY-N0771S8 [0,2,0,0,0,0|0,0,0]=2 31 B9R0.29 CCC(C)C(CC)C(N)=O HY-121877R [0,2,0,0,0,0|1,0,0]=3 32 B9R0.4 COCCN(C)CC(=O)O HY-W033132 [0,2,0,0,0,0|1,0,0]=3 33 B9R0.53 CC(CC(=O)O)CC(=O)O HY-113410R [0,2,0,0,0,0|0,0,1]=3 34 B9R1.35 O=C1CC[C@H](C(=O)O)N1 HY-W002304R [0,0,0,1,0,1|1,0,1]=4 35 B9R1.3 O=C1NCCC(O)C1Cl HY-N1815 [0,1,0,1,0,0|2,0,0]=4 36 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O HY-W089091 [0,1,0,1,0,0|1,0,0]=3 37 B9R1.66 CC1(O)CCOC(=O)C1 HY-107855R [0,1,0,1,0,0|0,0,0]=2 38 B5R0.5 CC(=O)N(C)C HY-W042416R [1,0,0,0,1,0|2,0,0]=4 39 B5R0.5 C[13C@H](O)C(=O)O HY-Y0479S3 [1,0,0,0,1,0|1,0,0]=3