0 B9R0.24 COC(=O)CCC(=O)CN HY-A0169A [0,0,0,0,0,0|2,0,0]=2 1 B9R0.24 COC(=O)CCC(=O)OC HY-Y0808 [0,0,0,0,0,0|0,0,0]=0 2 B9R0.24 COC(=O)\C=C\C(=O)OC HY-17363 [0,0,0,0,0,0|0,0,2]=2 3 B9R0.24 COC(=O)\C=C\C(=O)OC HY-17363R [0,0,0,0,0,0|0,0,2]=2 4 B9R0.24 O=C(CCC(=O)O[Na])O[Na] HY-W015410 [0,0,0,0,0,0|2,0,0]=2 5 B9R0.24 O=C(CCC(=O)O[Na])O[Na] HY-W094516 [0,0,0,0,0,0|2,0,0]=2 6 B9R0.24 O=C(\C=C\C(=O)O[Na])O[Na] HY-W015883A [0,0,0,0,0,0|2,0,2]=4 7 B8R0.6 CCCCCC(=O)O[Na] HY-W099696 [1,0,0,0,0,0|2,0,1]=4 8 B8R0.6 C\C=C\C=C\C(=O)OC HY-W068700 [1,0,0,0,0,0|1,0,2]=4 9 B8R0.9 CCC(=O)NCC(=O)O HY-W587803 [1,0,0,0,0,0|2,0,0]=3 10 B8R0.9 COC(=O)CCC(C)=O HY-N3272 [1,0,0,0,0,0|0,0,0]=1 11 B8R0.9 COC(=O)\C=C\C(=O)O HY-103252 [1,0,0,0,0,0|0,0,2]=3 12 B8R0.9 NCC(=O)CCC(=O)O HY-N0305 [1,0,0,0,0,0|2,0,0]=3 13 B8R0.9 NCC(=O)CCC(=O)O HY-N0305R [1,0,0,0,0,0|2,0,0]=3 14 B8R0.9 NCC(=O)NCC(=O)O HY-D0889R [1,0,0,0,0,0|3,0,0]=4 15 B10R0.46 C=C(CC(=O)OC)C(=O)OC HY-W041892 [0,1,0,0,0,0|0,0,1]=2 16 B10R0.46 COC(=O)CC(N)C(=O)OC HY-W067478 [0,1,0,0,0,0|0,0,0]=1 17 B10R0.46 N[C@@H](CC(=O)O[Na])C(=O)O[Na] HY-N0666D [0,1,0,0,0,0|2,0,0]=3 18 B10R0.46 O=C(CC(O)C(=O)O[Na])O[Na] HY-W250303 [0,1,0,0,0,0|2,0,0]=3 19 B10R0.46 O=C(CC(O)C(=O)O[Na])O[Na] HY-W250303A [0,1,0,0,0,0|2,0,0]=3 20 B10R0.46 [C@H](N)(CC(=O)OC)C(=O)OC HY-W009840 [0,1,0,0,0,0|0,0,0]=1 21 B10R0.108 CCOC(=O)CNC(=O)CN HY-W153793 [0,1,0,0,0,0|3,0,0]=4 22 B10R1.14 COC(=O)[C@@H]1CCC(=O)C1 HY-W057459 [0,0,0,1,0,0|1,0,0]=2 23 B10R1.14 COC(=O)[C@@H]1COC(=O)N1 HY-Z0425 [0,0,0,1,0,0|1,0,0]=2 24 B8R0.19 CCC(=O)CC(=O)OC HY-W010394 [0,0,0,0,1,0|1,0,0]=2 25 B8R0.19 COC(=O)CC(=O)OC HY-Y1787 [0,0,0,0,1,0|0,0,0]=1 26 B8R0.19 O=C(CC(=O)O[Na])O[Na] HY-W017165 [0,0,0,0,1,0|2,0,0]=3 27 B10R0.59 COC(=O)CCCC(=O)OC HY-W089014 [0,0,0,0,0,1|0,0,0]=1 28 B7R0.3 COC(=O)CCCBr HY-W004701 [2,0,0,0,0,0|1,0,1]=4 29 B7R0.3 COC(=O)CCCN HY-79594 [2,0,0,0,0,0|1,0,1]=4 30 B7R0.3 CO\C=C\C(=O)OC HY-W007972 [2,0,0,0,0,0|0,0,1]=3 31 B7R0.4 CC\C=C\CC(=O)O HY-W010532 [2,0,0,0,0,0|1,0,1]=4 32 B7R0.6 C(C(=O)O)=CC(=O)O HY-W015883 [2,0,0,0,0,0|0,0,2]=4 33 B7R0.6 CC(=O)CCC(=O)O HY-Y0839 [2,0,0,0,0,0|0,0,0]=2 34 B7R0.6 CC(=O)NCC(=O)O HY-Y0069 [2,0,0,0,0,0|1,0,0]=3 35 B7R0.6 CC(=O)NNC(C)=O HY-I0777 [2,0,0,0,0,0|2,0,0]=4 36 B7R0.6 CC(C)CCC(=O)O HY-W015882 [2,0,0,0,0,0|1,0,1]=4 37 B7R0.6 CC(C)CCC(=O)O HY-W015882R [2,0,0,0,0,0|1,0,1]=4 38 B7R0.6 O=C(O)C#CC(=O)O HY-W094710 [2,0,0,0,0,0|0,0,2]=4 39 B7R0.6 O=C(O)CCC(=O)O HY-N0420 [2,0,0,0,0,0|0,0,0]=2 40 B7R0.6 O=C(O)CCC(=O)O HY-N0420R [2,0,0,0,0,0|0,0,0]=2 41 B7R0.6 O=C(O)CC[N+](=O)[O-] HY-W012875 [2,0,0,0,0,0|1,0,1]=4 42 B7R0.6 O=C(O)\C=C/C(=O)O HY-Y0367 [2,0,0,0,0,0|0,0,2]=4 43 B7R0.6 O=C(O)\C=C\C(=O)O HY-107829 [2,0,0,0,0,0|0,0,2]=4 44 B7R0.6 O=C(O)\C=C\C(=O)O HY-W015883R [2,0,0,0,0,0|0,0,2]=4 45 B7R0.6 O=C([O-])CCC(=O)[O-] HY-W105775 [2,0,0,0,0,0|0,0,2]=4 46 B7R0.6 O=[13C](O)CC[13C](=O)O HY-N0420S3 [2,0,0,0,0,0|0,0,0]=2 47 B9R0.8 COC(=O)[C@@H](N)CCSC HY-W014916 [1,1,0,0,0,0|0,1,1]=4 48 B9R0.8 COC(=O)[C@H](N)CCSC HY-W014917 [1,1,0,0,0,0|0,1,1]=4 49 B9R0.34 CCCC(O)CC(=O)OC HY-116632 [1,1,0,0,0,0|1,0,1]=4 50 B9R0.46 CCCCCCC(=O)OC HY-141610 [1,1,0,0,0,0|1,0,1]=4 51 B9R0.7 CC(C)C(=O)NCC(=O)O HY-W141928 [1,1,0,0,0,0|2,0,0]=4 52 B9R0.7 CC(S)C(=O)NCC(=O)O HY-B0373 [1,1,0,0,0,0|2,0,0]=4 53 B9R0.7 O=C(O)CCC(=O)C(=O)O HY-W013636 [1,1,0,0,0,0|2,0,0]=4 54 B9R0.7 O=C(O)CCC(=O)C(=O)O HY-W013636C [1,1,0,0,0,0|2,0,0]=4 55 B9R0.7 O=C(O)CCC(=O)C(=O)O HY-W013636R [1,1,0,0,0,0|2,0,0]=4 56 B9R0.7 O=[13C](O)[13CH2][13CH2][13C](=O)[13C](=O)O HY-W013636S [1,1,0,0,0,0|2,0,0]=4 57 B9R0.23 COC(=O)C(O)CC(C)C HY-22167 [1,1,0,0,0,0|1,0,1]=4 58 B9R0.23 COC(=O)[C@H](N)CC(C)C HY-W016425 [1,1,0,0,0,0|1,0,1]=4 59 B9R0.23 N[C@@H](CC(=O)O)C(=O)O[K] HY-N0666A [1,1,0,0,0,0|1,0,0]=3 60 B9R0.23 [C@H](N)(CC(C)C)C(=O)OC HY-W016427 [1,1,0,0,0,0|1,0,1]=4 61 B9R0.42 C=C(CC(=O)OC)C(=O)O HY-W094214 [1,1,0,0,0,0|0,0,1]=3 62 B9R0.42 COC(=O)C[C@H](N)C(=O)O HY-Y1801 [1,1,0,0,0,0|0,0,0]=2 63 B9R0.42 N[C@@H](CC(=O)O[Na])C(=O)O HY-W140900 [1,1,0,0,0,0|1,0,0]=3 64 B9R0.48 CCCC(=O)NCC(=O)O HY-113119 [1,1,0,0,0,0|2,0,0]=4 65 B9R0.48 CCOC(=O)CNC(C)=O HY-W015651 [1,1,0,0,0,0|1,0,0]=3 66 B9R0.48 CCOC(=O)\C=C\C(=O)O HY-W019696 [1,1,0,0,0,0|0,0,2]=4 67 B9R0.26 COC(=O)CC(OC)OC HY-W017474 [0,1,0,0,1,0|0,0,2]=4 68 B11R0.110 COC(=O)CC(=O)CC(=O)OC HY-W016801 [0,1,0,0,0,1|0,0,0]=2 69 B11R0.110 COC(=O)CC(O)CC(=O)OC HY-W008294 [0,1,0,0,0,1|0,0,0]=2 70 B11R0.120 COC(=O)CCC(=O)C(=O)OC HY-44134 [0,1,0,0,0,1|0,0,0]=2 71 B11R0.120 COC(=O)CCC(=O)C(=O)OC HY-44134R [0,1,0,0,0,1|0,0,0]=2 72 B11R0.120 COC(=O)CC[C@@H](N)C(=O)OC HY-Y0749A [0,1,0,0,0,1|0,0,0]=2 73 B11R0.120 COC(=O)CC[C@H](N)C(=O)OC HY-Y0749 [0,1,0,0,0,1|0,0,0]=2 74 B11R0.120 COC(=O)CNC(=O)C(=O)OC HY-15893 [0,1,0,0,0,1|0,0,1]=3 75 B11R0.120 O=C(CCC(=O)C(=O)O[Na])O[Na] HY-W339545A [0,1,0,0,0,1|2,0,0]=4 76 B11R0.120 O=C(CCC(=O)C(=O)O[Na])O[Na] HY-W802699 [0,1,0,0,0,1|2,0,0]=4 77 B11R0.120 O=C(CCC(O)C(=O)O[Na])O[Na] HY-113038A [0,1,0,0,0,1|2,0,0]=4 78 B11R0.120 O=C(CC[C@H](O)C(=O)O[Na])O[Na] HY-W015114 [0,1,0,0,0,1|2,0,0]=4 79 B11R0.66 O=C(O[Na])[C@H](O)[C@@H](O)C(=O)O[K] HY-ER007 [0,2,0,0,0,0|2,0,0]=4 80 B11R0.66 O=C(O[Na])[C@H](O)[C@@H](O)C(=O)O[K] HY-Y1332 [0,2,0,0,0,0|2,0,0]=4 81 B11R0.66 O=C(O[Na])[C@H](O)[C@@H](O)C(=O)O[Na] HY-128476 [0,2,0,0,0,0|2,0,0]=4 82 B11R0.66 [2H]\C(C(=O)OC)=C(\[2H])C(=O)OC HY-17363S1 [0,2,0,0,0,0|0,0,2]=4 83 B11R0.88 O=C(CC(S[Au])C(=O)O[Na])O[Na] HY-106381A [0,2,0,0,0,0|2,0,0]=4 84 B11R0.62 CCOC(=O)CCC(=O)OCC HY-Y0836 [0,2,0,0,0,0|0,0,0]=2 85 B11R0.62 CCOC(=O)\C=C/C(=O)OCC HY-Y1147 [0,2,0,0,0,0|0,0,2]=4 86 B11R0.62 CCO[13C](=O)[13CH2][13CH2][13C](=O)OCC HY-Y0836S [0,2,0,0,0,0|0,0,0]=2 87 B9R1.35 O=C1CCC(C(=O)O)N1 HY-W012738 [1,0,0,1,0,0|2,0,0]=4 88 B9R1.35 O=C1CC[C@@H](C(=O)O)N1 HY-76082 [1,0,0,1,0,0|2,0,0]=4 89 B9R1.35 O=C1CC[C@@H](C(=O)O)N1 HY-76082R [1,0,0,1,0,0|2,0,0]=4 90 B9R1.35 O=C1CC[C@H](C(=O)O)N1 HY-W002304 [1,0,0,1,0,0|2,0,0]=4 91 B9R1.35 O=C1N[C@H](C(=O)O)CS1 HY-133105 [1,0,0,1,0,0|1,1,0]=4 92 B9R1.48 O=C1CCCCC(=O)C1 HY-W002860 [0,0,0,1,1,0|2,0,0]=4 93 B7R0.2 CC(=O)CC(=O)O[Na] HY-112540B [1,0,0,0,1,0|1,0,0]=3 94 B7R0.2 COC(=O)CC(C)=O HY-Y1298 [1,0,0,0,1,0|0,0,0]=2 95 B7R0.2 [C@@H](C)(O)CC(=O)OC HY-W012885 [1,0,0,0,1,0|0,0,2]=4 96 B7R0.2 [C@H](C)(O)CC(=O)OC HY-W010507 [1,0,0,0,1,0|0,0,2]=4 97 B7R0.2 [Li]OC(=O)CC(C)=O HY-112540A [1,0,0,0,1,0|1,0,0]=3 98 B7R0.10 CCC(=O)C(=O)O[Na] HY-W005355 [0,0,0,0,2,0|2,0,0]=4 99 B7R0.10 O=C(O[Na])C(=O)O[Na] HY-Y0262B [0,0,0,0,2,0|2,0,0]=4 100 B11R0.106 COC(=O)CCCCC(=O)OC HY-W015301 [0,0,0,0,0,2|0,0,0]=2