Added 187 molecules from epoch 16596 for Q8BRU6
Browse files- Q8BRU6_molecules.csv +187 -0
Q8BRU6_molecules.csv
CHANGED
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@@ -18730,3 +18730,190 @@ rxn:2:117008:128819,,
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| 18730 |
rxn:2:120312:104290,,
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| 18731 |
rxn:2:128819:113016,,
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| 18732 |
rxn:2:128819:117008,,
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| 18730 |
rxn:2:120312:104290,,
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| 18731 |
rxn:2:128819:113016,,
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| 18732 |
rxn:2:128819:117008,,
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| 18733 |
+
00AC8266A88C2E77_584786E0B7D79940_6035_UN,CCCCC2CCC(COC1=C(OC)C=CC(=C1OC)Br)CC2,NZRPOMHYAUJETH-UHFFFAOYSA-N
|
| 18734 |
+
015F587F3DD59AF7_83C55C6F2A771D11_6034_DP,O=C1N(C=CC2=C1[NH]N=C2)CC45OC3(CNC3)C(C4)(N)C5,QPBVAIWOYCWHDV-UHFFFAOYSA-N
|
| 18735 |
+
0260A6F7818AA962_BC6542AF79EFD6B8_6041_UN,O=[N](=O)C1=CC(=CC(=C1)N[CH]2CC[C](=[CH]F)CC2)[S](=O)(=O)F,YQZANWDTVABVKS-UHFFFAOYSA-N
|
| 18736 |
+
027A2F50E9A1E2E3_4D0B876F6CA0348A_6035_UN,CN3C(=C(COC1=C(OC)C=C(C=C1)C2SCCS2)C[N]4N=NN=C34)C,YRKNAKNVYQKFOC-UHFFFAOYSA-N
|
| 18737 |
+
02FF62CEB1664905_57FA0BA0CE743EF5_6041_DP,COC1=C(C(=CC(=C1)C=NO)NC2C(NCCC2C)C)OC,ISDVTBGIVQHQQN-UHFFFAOYSA-N
|
| 18738 |
+
03814472B43064AB_6079827A63DE4CC7_6031_UN,O(C(=O)[C@H]2[C@H]1CNC[C@H]1OC2)CC3=CC=CC(=N3)C(OC)=O,UFSVVOXWHFMNGD-NQBHXWOUSA-N
|
| 18739 |
+
047791F736A1B85D_471227EE124E2253_6041_UN,OC(=O)C1=C(C=NC(=C1)NC(CCC)C(=NO)O)C#N,YCAKTBHFGRRISL-UHFFFAOYSA-N
|
| 18740 |
+
09C6CDFE8BC6D701_4BB935F053493046_6035_UN,NCC13CC(C1)(COC2=C(C(=N[NH]2)C(OC)=O)Br)CO3,MJCVEAMMZSNWBJ-UHFFFAOYSA-N
|
| 18741 |
+
0A58F4DA0941EC71_63638D2D1B36EEA4_6034_UN,CN1C=C(C(=NO)N)C(=O)N(C1=O)C[C@H]2[C@@H](CNC2)F,VXWCXDQLRBMKOD-POYBYMJQSA-N
|
| 18742 |
+
0C496C99B2632D80_E84AE0A36170A243_6038_UN,CCOC(=O)C14CC(C1)(CNC(C3=CN=C2[N](N=CC2=C3OC)C)=O)OC4,YXFDFCFRKLYDAN-UHFFFAOYSA-N
|
| 18743 |
+
0CE17CDE91F228AF_A7895E7DCB5E81EF_6035_UN,C[C@H]2CC(COC1=C(C(=N[NH]1)C(OC)=O)Br)C[C@@H](C)O2,KAIHNLWCCCVTER-JVHMLUBASA-N
|
| 18744 |
+
0D8515C970A2057B_B831DADB24E7A2EA_6031_DP,NC1CC(C1)N[C@H]2C[C@H](C2)C(=O)OCC3=CN=C(OC)C=C3OC,DMONDPGCADOVDO-KXMXVIIZSA-N
|
| 18745 |
+
0E2CAA90AB244B6E_0267153C0C42E196_6031_DP,COC1C[C@@H]2CC(C[C@H]12)C(=O)OCC45OC3(CNC3)C(C4)(N)C5,WWWBTPVQMHYZND-FHIVIMKCSA-N
|
| 18746 |
+
11DFA127C283270A_D46692248C9350C2_6031_DP,NC[C@@H]1CNC[C@H]1C(=O)OCC23CC(C(OC)=O)(C2)OC3,AWDGYJWOAXQJDU-UZXYAUHMSA-N
|
| 18747 |
+
1225904E1716782C_241D8204C5EB852F_6035_DP,N4CC3CC(COC1=NC(=NC2=C(C#N)C=N[N]12)S)(C3)C4,FXMYHWGEDLDBPP-UHFFFAOYSA-N
|
| 18748 |
+
12BBE276107DA56B_981150EF0D7FB7EA_6035_UN,NCC23CC(COC1=CC(=C(C(=C1)OC)Br)OC)(CO2)CCC3,FQALSIZMHAJRKR-UHFFFAOYSA-N
|
| 18749 |
+
12CCEC5254C72F8B_FCE8035F2D5BD061_6003_DP,N2CC(OC1=CC(=C(C=C1C(OCC)=O)[N](=O)=O)F)C2,LQGSUVGLRMCQEE-UHFFFAOYSA-N
|
| 18750 |
+
14D8BA2AC5B8293B_2229D3B3B4AE34A0_6034_UN,COC1=CC2=C(C(=C1)OC)C(=O)C=CN2CC3CC4CCC(C3)[S]4(=O)=O,NMBISVURJMMJRL-UHFFFAOYSA-N
|
| 18751 |
+
14FD5B008425E32C_969A4122D85C0E3B_6038_UN,COC(=O)C2C[C@H]1[C@@H](C[C@H]1C2)NC(C34CC(C(C)(C)C)(C3)C4)=O,VFAPWBBKDHJGDT-DOOCARBZSA-N
|
| 18752 |
+
1535CBE4BB885517_51EBB9102485ABCD_6029_UN,FC12CC(C1)N(C2)[S](C3=C([N](=O)=O)C=C(C=C3)CBr)(=O)=O,QOFXJUGVOSJMIN-UHFFFAOYSA-N
|
| 18753 |
+
1A4D489F9C231051_DFF79752BA6022E4_6035_UN,O(C[C@H]2[C@H]1CNC[C@H]1OC2)C3=CC(=NC(=N3)N)C(OC)=O,SKQMNAPDEAOGJD-QXFUBDJGSA-N
|
| 18754 |
+
1A565F6E766AD22C_BC61218D1B0F4E1A_6034_DP,CCOC1=NC=CN(C1=O)CC34OC2(CNC2)C(C3)(N)C4,HIBCUKNTDUPJPN-UHFFFAOYSA-N
|
| 18755 |
+
1E17C5D6ACC08E70_804F067D049EAB63_6031_UN,C[C@H]1CN[C@@H](CC1)C(=O)OCC2=CN=C(OC)C=C2OC,YFAQSYUVHGWGBG-PWSUYJOCSA-N
|
| 18756 |
+
1F34981B34BC3F53_24F74F73D0ACD046_6041_UN,OC(=O)C1=CSC(=N1)C2=CC(=C(C=C2)F)NC(CCC)C(=NO)O,AJOBSHCUHJZCEC-UHFFFAOYSA-N
|
| 18757 |
+
20396D655B85DAA7_F0C23B099C16D14F_6041_DP,O=[N](=O)C1=CC(=CC(=C1)N[C@@H]2CC[C@@H](O)CC2)[S](=O)(=O)F,ADQBYVJNGQUNEQ-JLIMDTESSA-N
|
| 18758 |
+
20821B0EB4494132_E0B591BAD274E8CC_6026_UN,O=[N](=O)C1=C(C=CC(=C1)[S](=O)(=O)N3CC2CC(F)(C2)C3)C#N,HJUJSABSGZJBIM-UHFFFAOYSA-N
|
| 18759 |
+
211DF96DF4EDBF2F_C8041D2A3A19A13A_6041_UN,C[N]1C(=NC2=C1C(NC(N2C)=O)=O)NCCC34CC(C)(C3)OC4,CIBHCNDBNSLEBI-UHFFFAOYSA-N
|
| 18760 |
+
2447A95B7CBE6BE1_A4B20B7BD77692E9_6034_UN,NCCC1=CN(C2=C1C=C(C=C2)[N](=O)=O)C[CH]3C[C](=[CH2])C3,MFNDVPRORBHLCJ-UHFFFAOYSA-N
|
| 18761 |
+
284FF077786373D4_7A5B6206665CB4F8_6038_UN,N(C[C@@H]1CC[C@@H](O1)C2CC2)C(C3=CSC(=N3)C(OC)=O)=O,UVZPWIAVTBDSOG-GXSJLCMTSA-N
|
| 18762 |
+
2CA4A462B946429D_B311360BA5C993A4_6041_UN,OC(=O)[C@@H]1C[C@H]1C2=CN=C(C=C2)NCC(C(OC)=O)(C)C,IBGMSFJJUFZUSX-WDEREUQCSA-N
|
| 18763 |
+
2D6C2A0ED599A483_D9A37C8F4CCB7ED0_6035_UN,O(C1(CNC1)C2CC2)C3=C(ON=C3C(OC)=O)C(=O)OC,CACGFPKGIAIKSC-UHFFFAOYSA-N
|
| 18764 |
+
2EC063E98E038950_B3D5A7FFE9D8950F_6035_DP,N4C[C@@H]3CC[C@@H](OC2=C(CC)C=C1C(=CC(OC1=C2)=O)CCl)[C@@H]3C4,ZYXBDQSWFPQAME-APHBMKBZSA-N
|
| 18765 |
+
2F00302F0D38C210_FED029342915FE53_6027_UN,O=[N](=O)C1=CN(N=C1C2CCC2)[S](C3=CC(=C(C)C(=C3)Cl)Cl)(=O)=O,IIRQHIBERGIGDV-UHFFFAOYSA-N
|
| 18766 |
+
2F2045EAE6425226_229AA5251529B234_2875_UN,OC(=O)C13CCC(CC1)([N]2N=NC(=C2)C(COC)N)C3,QHGWHIDHKUAZMK-UHFFFAOYSA-N
|
| 18767 |
+
2F84A1D67CC92697_DA59F68F0D3FC13A_6031_DP,N1CCC(CC1)N[C@H]2C[C@H](C2)C(=O)OCC(C)(N)CCF,IUHKDVYAFPIVPD-ZNNAUIGFSA-N
|
| 18768 |
+
317C3AC8A34D8E59_37AB20D72ED0EB01_6031_UN,CCC[C@H]1[C@@H](CNC1)C(=O)OCC2=C(ON=C2OC)C,OUETVUVCLAATQY-GHMZBOCLSA-N
|
| 18769 |
+
31C22271D2E6A091_E2B41970F077CEB3_6026_UN,COC1=CC(=C(C(=C1)OC)[S](=O)(=O)N2CC3CC2(C#C)C3)OC,DQMRYUYGYWERRM-UHFFFAOYSA-N
|
| 18770 |
+
3438F7DBE2E7841C_DC28ED362B045E4E_6029_UN,N(C1=C(C=C(C(=C1)[N]2C=CC=N2)F)[N](=O)=O)[S](C3=NOC(=C3)C4CO4)(=O)=O,HVXAFUGMPCFXMI-UHFFFAOYSA-N
|
| 18771 |
+
3A7DA0DA644EF2FC_4AAB0F7723D247D1_6041_UN,COC1=CC(=C(C(=C1)OC)NCC23CCN(CC2)CC3)C(=O)O,PHBTYHIMZUIELI-UHFFFAOYSA-N
|
| 18772 |
+
3B5BEE6542F45E99_2B0587DA5945F3B8_6038_UN,CN2CCCC(=COC(C(C)(C)C1=CSN=C1)=O)C2=O,WFNSCLPHNAJNIC-UHFFFAOYSA-N
|
| 18773 |
+
3C608FD62DBE1EC3_9795986B00F68AAE_6031_UN,O(C(=O)C23CC1CC(F)(CC(F)(C1)C2)C3)C[CH]4CC[C](=[CH2])CC4,CBBZZXMWTXITDP-UHFFFAOYSA-N
|
| 18774 |
+
3C72F3B5C097B9ED_C7F631AAE3201060_6034_DP,O=C2C=CC1=C(C=CC=N1)N2CC45OC3(CNC3)C(C4)(N)C5,ZDMKOYBJJDPXHY-UHFFFAOYSA-N
|
| 18775 |
+
3ECE8D46C3765AEA_6E09570ABC1E96EA_6039_UN,O(C1C[C@@H](C[C@@H](C1)C(=O)O)C(=O)O)CC2=CC(=NC(=C2)OC)OC,LHRNFXNDBPFFKV-FOSCPWQOSA-N
|
| 18776 |
+
3F28E561D4B11364_4D7580CC9A76140B_6029_UN,N(C(C1CCC1)C2=CC=C(C=C2)Cl)[S](C3=NOC(=N3)C(OCC)=O)(=O)=O,UERMXGRVOXNPBQ-UHFFFAOYSA-N
|
| 18777 |
+
3F8F03BCBECDD702_2830BF02B7DE0E7A_6031_UN,C[C@H]1[C@H](CNCC1)C(=O)OCC2=CN=C(OC)C=C2OC,OLKXNYXQODNXDL-PWSUYJOCSA-N
|
| 18778 |
+
42426F43D1AFECFE_6C8CED727410ACDA_6031_UN,CCOC1CC(C1)C(=O)OCC2=NC(=CC(=C2)OC)Cl,HAPGXLLSALSDCI-UHFFFAOYSA-N
|
| 18779 |
+
428F8165F9A6C4B8_B07DB70FE269972B_6041_UN,C1(=CC2=C(C=C1)OC(=N2)C#N)N[C@H]3[C@H](COC3)C(=O)O,RAQSFELJMKDWQF-WCBMZHEXSA-N
|
| 18780 |
+
42C5FA74FD6B9135_FEC27411CBAAA9C3_6038_DP,COCC1=CC(=C(N=C1)OC)COC([C@@H]2C[C@H]2C3CCNCC3)=O,ZBGQYGVJXDVNLQ-JKSUJKDBSA-N
|
| 18781 |
+
439AFD5ACA211FFB_F83FE0694B12CA89_6038_DP,OC(=O)[C@@H]1CCC[C@@H]1NC(C2=CSC(=N2)C(OC)=O)=O,RGJAYYOROJPTHO-RQJHMYQMSA-N
|
| 18782 |
+
4503101CC457B1BE_933BAC4B9711421C_6039_UN,O(C1=CC(=O)NC2=C1C=CC=N2)CC3OC3CCCC,NRENKWDFAQAQSR-UHFFFAOYSA-N
|
| 18783 |
+
483B1F82E5A9274D_425E5E681D667141_6034_DP,N1CC(C1)N2C=C(C#N)C(=O)N(C2=O)CC45OC3(CNC3)C(C4)(N)C5,BZQGXFAERIFNJM-UHFFFAOYSA-N
|
| 18784 |
+
4A14D88864386376_FDCFB1C67DC0FF8D_6038_DP,OC(=O)[C@@H]1CC[C@H]1COC(C3CC2=C(C=C(OC)C=C2N3)OC)=O,LYHQJXDVQVFVST-ZVXSNUFUSA-N
|
| 18785 |
+
4AB6FD9DC4658BB9_F2C0CE66557206F2_6035_UN,O(CC2CC1(CC1F)C2)C3=CC(=C(C(=C3)OC)Br)OC,CAZSTTMZDMVHCS-UHFFFAOYSA-N
|
| 18786 |
+
4BE5E018209A1C9E_1A1CE04625373C1B_6031_UN,O(C(=O)[C@@H]1CCO[C@H]1C=C)CCC2=CN=C(OC)N=C2,VBFPIHCNADDMIS-NEPJUHHUSA-N
|
| 18787 |
+
4BEAC534F257F487_1336DCBBDB72BF95_6041_UN,FC2=C1C(=N[NH]C1=CC(=C2)C#N)NCC3CC(C3)C(=O)O,IVKIVUKEZNLZOY-UHFFFAOYSA-N
|
| 18788 |
+
4C38117051DA34D8_D0D78E2EF2D6D34A_6034_UN,CC1CCC2=C(C1)SC3=C2C(N(C=N3)C(CC)=C(N=O)C(=O)OC)=O,OLDSPCYHNJBSED-UHFFFAOYSA-N
|
| 18789 |
+
4C7D66A135A4C625_ECD2FE1E5E204F44_6035_UN,NC[C@@]12[C@@H](CNC1)CCC2OC3=CC(=C(C(=C3)OC)Br)OC,JIECXKWOPHSFGQ-LAEKFQSZSA-N
|
| 18790 |
+
4CC0BBE277BDBA90_02EB277B4F164B87_6031_UN,O(C(=O)C1=C(C(NC(=C1)C2CC2)=S)C#N)CC(=C(C)C)Br,XHFLDCCCBWYHJB-UHFFFAOYSA-N
|
| 18791 |
+
4D394F40A338ADE8_02EF184D51FCB885_6029_UN,N(C1=C(C=C(C=C1)C2=NC(=NO2)C3CC3)Cl)[S](C4=CC=C(C=C([N](=O)=O)Br)O4)(=O)=O,HMYXEKRQUXCLOA-UHFFFAOYSA-N
|
| 18792 |
+
5033D2CAD6E48B44_9FA6521BC0F9926E_6029_UN,C(OC1=CC2=C(C=C1)C=C[N]2[S](C3=NOC(=N3)C4=CC=C(F)C=C4)(=O)=O)C5CO5,ZSLZOSDDEAWIDU-UHFFFAOYSA-N
|
| 18793 |
+
50612BCB6FC72E75_D99AE28A9EB58675_6035_UN,O(CC1CCC(CI)OC1)C2=C(C=NC3=C2C=C(OC)C=C3OC)C#N,HDEZXGQRUCAZPU-UHFFFAOYSA-N
|
| 18794 |
+
50AC6A2869830EB7_6199CC5E4C469E8E_6035_UN,C[C@H]2CC(COC1=CC(=NC(=N1)N)C(OC)=O)C[C@@H](C)O2,GECBCBKHYOHYPE-ULKQDVFKSA-N
|
| 18795 |
+
5198925DDD1D03D7_4258C82801B3FBBA_6035_UN,N[C@@H]1C[C@@H](C[C@H]1OC2=CC(=NC(=N2)N)C(OC)=O)C#N,ZPUVRWFXTPFFGY-LKEWCRSYSA-N
|
| 18796 |
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B47389705BA6C3DE_2743D9BE4C1FEDC6_6035_DP,OC(=O)[C@H]1C[C@@H]([C@@H](C1)OC2=CC(=C(C(=C2)OC)Br)OC)CN,KAKIQXBJJOIDOX-IQJOONFLSA-N
|
| 18880 |
+
B51093BA794D4F01_FD1712465B909EBE_6041_UN,CC2=NC1=C(C=N[N]1C(=C2)NCC34CC(C(OC)=O)(C3)C4)C#N,GPDXWSHWTDZSJP-UHFFFAOYSA-N
|
| 18881 |
+
B51A9F0164D63B63_68E516D181911A25_6038_UN,COC1=C(C=CC(=C1)NC(CC2=NC(=NO2)C3C(C)C3)=O)[S](=O)(=O)F,LHEDEBVAEBJMSJ-UHFFFAOYSA-N
|
| 18882 |
+
B55940FD3C9E2435_AFBA0F79C9A545C6_6034_DP,O=[N](=O)C1=CC2=C(C=C1)C(=C[N]2CCC3CNC3)[S](=O)(=O)Cl,VTDDJOMYLDJFKK-UHFFFAOYSA-N
|
| 18883 |
+
B55940FD3C9E2435_F0F9A58249800780_6034_UN,O=[N](=O)C1=CC2=C(C=C1)C(=CN2CCC3CNC3)[S](=O)(=O)Cl,VTDDJOMYLDJFKK-UHFFFAOYSA-N
|
| 18884 |
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B5A08BD68EE96F48_F07BD9E53EE85203_6041_UN,OC(=O)C2=C1NC(NC1=CC(=C2)N[CH]3CC[C](=[CH]F)CC3)=O,QFVBWWGEQVMSRB-UHFFFAOYSA-N
|
| 18885 |
+
B64CB75D8FEB632D_1E311FBE3ECE9266_6041_UN,O=[N](=O)C1=CC(=C(C=C1)S)NC2=C[N](N=C2)C3=NC=CC=C3,LKJOZVOSGSCEBX-UHFFFAOYSA-N
|
| 18886 |
+
B6FF0AB44B8A8F15_8971C1C996411CA2_7005_UN,COC1=CC(=CC2=C1[NH]C(=N2)C3C(OC(C)CN3)C)C#N,CWQMLUOLXDNSIL-UHFFFAOYSA-N
|
| 18887 |
+
B735DF5C1C992EBC_1AF1D707A2858F99_6038_UN,CCCCC(NC(=O)C1CC(=O)NC2=C1C=CC=N2)C(=NO)O,RFNFHDHUYOIPQO-UHFFFAOYSA-N
|
| 18888 |
+
B999DB49A759B4DD_C118A89310E30AC3_6031_DP,OC(=O)[C@H]1CC[C@H](O1)C(=O)OCC2=NC(=CC(=C2)OC)Cl,SZLATUFQBGFKPB-ZJUUUORDSA-N
|
| 18889 |
+
C037B00F6AE68D02_081A72E094D229E6_6029_UN,O=[N](=O)C1=C[N](N=C1C2CCC2)[S](C3=CC(=C(C=C3C#N)F)F)(=O)=O,XNBSEPFGDXEFIT-UHFFFAOYSA-N
|
| 18890 |
+
C08E8C50A97D4E49_0B59CE14780A5193_6041_UN,OC(=O)C1=NSC(=C1)N[C@H]3[C@H](C2=CC(=C(C=C2OC)C)OC)C3,QWVJIWFRCWYUNS-GXSJLCMTSA-N
|
| 18891 |
+
C292D4F2C2A09EE9_D478118A1BA158AD_6035_UN,O(C1COC2=C1C=CC(=C2)Cl)C3=C(OC)C=C(C=C3)C(=NO)N,CMEZUTCGDOILEP-UHFFFAOYSA-N
|
| 18892 |
+
C68EDC11234D673E_4116BDB0210DC3C0_6029_UN,COC12CC(C1)CN(C2)[S](C3=CC(=C(C(=C3)OC)O)OC)(=O)=O,CWYIGVVTUKUARL-UHFFFAOYSA-N
|
| 18893 |
+
C6A8A6BE41393CB9_49CA220D3F35D44D_6035_UN,CCCC2CCC(OC1=CC=CC(=C1C=NO)Br)C(C2)OC,XWFINOLSPMGAIT-UHFFFAOYSA-N
|
| 18894 |
+
C7ECA85FEA411BD0_DBBC5CDB8197E946_6029_UN,OC(=O)C1=CSC(=N1)C2=C[N](N=C2)[S](C3=CC=C(C=C(C)[N](=O)=O)O3)(=O)=O,HDBSARIIEYPPPJ-UHFFFAOYSA-N
|
| 18895 |
+
C958FE61AC5EEF0B_6BB7530B2130C9C7_6038_DP,COCC1=CC(=C(N=C1)OC)COC([C@H]2[C@@H](CNC2)C3CC3)=O,LECFPDWGKKNLCJ-LSDHHAIUSA-N
|
| 18896 |
+
CB2773DFD3E24461_6644B8DC7D2B22E4_6034_DP,COC1=NNC(=O)N(C1=O)CC34OC2(CCNCC2)C(C3)(N)C4,HWSBULBEMGSDCP-UHFFFAOYSA-N
|
| 18897 |
+
CD18C936735C2A2D_CC1AD084382706BA_6035_DP,N4C[C@@H]3CC[C@@H](OC2=C(C=C1C(=CC(OC1=C2)=O)CCl)Cl)[C@@H]3C4,NMOKFWSBRRIZKO-MRCXROJRSA-N
|
| 18898 |
+
CEA7C0452995E306_A8E85870E593D2A6_6026_UN,COC1=CC(=C(C(=C1)OC)[S](=O)(=O)N2CC3CC2(CF)C3)OC,OEEHFESLPBCQIJ-UHFFFAOYSA-N
|
| 18899 |
+
CF8D6E583EE59FD4_88ED072CB99305FE_6038_UN,N([CH]1CC[C](=[CH]F)CC1)C(C2=CSC(=N2)C(OC)=O)=O,ZSDQVBSWPWFGQC-UHFFFAOYSA-N
|
| 18900 |
+
D18B1F97411669B3_BAC3DDDCD38289A6_6034_DP,N1CC(C1)N2C=C(C#N)C(=O)N(C2=O)CC3NOCC3,FUUPCKBBXLLYAG-UHFFFAOYSA-N
|
| 18901 |
+
D1DEDA40C93A3938_92075BCF945CDF65_7019_UN,OC(=O)C1=CC(=C(C=C1)C=CC2=CN=C(O2)C3CC3)[N](=O)=O,GUJOZHRRGQZEBN-UHFFFAOYSA-N
|
| 18902 |
+
D2461C8FD0A07A63_07F8B7C865CB053C_6041_UN,COC1=C(C(=CC(=C1)C=NO)NC2CC3(C2)C(C3)C(=O)O)OC,MQMQIZUVTBZVHN-UHFFFAOYSA-N
|
| 18903 |
+
DA6204A9FA444B77_D3CECAFA365E762F_6035_DP,N4C[C@@H]3CC[C@H](OC2=CC=C1C(=CC(OC1=C2C)=O)CCl)[C@@H]3C4,IDLSLLWZODCJJX-PEYYIBSZSA-N
|
| 18904 |
+
DA7E49FEF75A995A_E0AFBDC629176293_6041_UN,COC1=C(C(=CC(=C1)C=NO)NC2CC(CCC2C)C(=O)O)OC,KMNPXHNTBBVAGS-UHFFFAOYSA-N
|
| 18905 |
+
E0073FA88CA28BF2_3791756EAFE35212_6038_UN,O(C2C[C@H]1CC(=O)C[C@H]1C2)C(C3=CSC(=N3)C(OC)=O)=O,QPQUNIMXFODCIG-JWHQNHQBSA-N
|
| 18906 |
+
E1E24C63ADB56C55_E6F7E6436A9664E0_6038_UN,CC2=CN=C3C(OC([C@H]1CC[C@@H](CCC(OC)=O)O1)=O)CC[N]23,WDHQLSOGTXEZAA-IAMFDIQRSA-N
|
| 18907 |
+
E86B39B7AEB0FB2A_EBF6A9BAE63E2A88_6031_DP,OC(=O)[C@H]1CC[C@H](O1)C(=O)OCC2=CSC(=N2)COC,XFDRCJOBXHLOPP-BDAKNGLRSA-N
|
| 18908 |
+
E879C737478856DC_08077A33A36A57A1_6035_UN,O(CC1=C(ON=C1Br)C2CC2)C3=C(OC)C=C(C=C3)C(=NO)N,DVDYQJWHYPFSJN-UHFFFAOYSA-N
|
| 18909 |
+
EBC18A4A1BC2271E_C105C7B6A76EAA56_6004_UN,CC2CC[N]1C=C(C=C1C(=O)N2)C3=CC(=C(C=C3Cl)C4CC4)C,CZLNRYQAFRJYMP-UHFFFAOYSA-N
|
| 18910 |
+
EBD66EF721785CF6_AEFA65D07D2A0432_6038_UN,CN2C(C1=C(C=N[N]1C=C2)CNC(C34CC(C)(C3)OC4)=O)=O,ZYRJRGNBXVNRAB-UHFFFAOYSA-N
|
| 18911 |
+
ED7BBBB9C8598EF4_488A2700F22B97F4_6029_DP,N(C1=CC=C(C=C1)N2CCC2=O)[S](C4=CC3=C([NH]N=C3)C(=C4)F)(=O)=O,QOTSWPFVOGIVFH-UHFFFAOYSA-N
|
| 18912 |
+
EE37CB533B6B3E45_29EACA8E6F66ADA6_6034_DP,N1CC(C1)N2C=C(C#N)C(=O)N(C2=O)CC3ON=C(C)C3,SQJDDGRDJJJKCP-UHFFFAOYSA-N
|
| 18913 |
+
F0ACFA102643656C_E12A2BD88E411762_6026_UN,O=[N](=O)C1=C(C=CC(=C1)Cl)[S](=O)(=O)NC2=C(N=CC=C2)[N]3C=NC=C3,IEHKOMNIHCCTIC-UHFFFAOYSA-N
|
| 18914 |
+
F5BD736F42E756E2_9D1FA86CDD856CD8_6031_DP,N1[C@@H]4[C@H](C[C@H]1C(=O)OCC23CC(C(OC)=O)(C2)OC3)C4(F)F,FIQQRTHMNOKYIX-BPRQQIMTSA-N
|
| 18915 |
+
F5BF07CD1AF5A643_3173BA97E7A8A9A4_7022_DP,CC1=C(C=C(C(=C1)NC2=NC(=N[N]2C)C3CNC3)Cl)C4CC4,GTPNMBOINDXZKX-UHFFFAOYSA-N
|
| 18916 |
+
F853E9D01F42FE45_B00EB2B7BD4F5058_6029_UN,COC12CC(C1)CN(C2)[S](C3=CC(=C(OCCC)C=C3)CCl)(=O)=O,HPLDECGRYAKGCK-UHFFFAOYSA-N
|
| 18917 |
+
F9407CE5A1D14F01_666060EB101638C6_6035_UN,O(C1CCCC1C#N)C2=C(C=NC3=C2C=C(OC)C=C3OC)C#N,YCDMSHZWGUGJCO-UHFFFAOYSA-N
|
| 18918 |
+
FA93AC4EB9BFCFC6_6F779B0E41574306_7019_UN,CC1OCCN(C1)CC=CC3=CC(=C2C=CC=CC2=C3O)Cl,YUZDZVYAQJXNQL-UHFFFAOYSA-N
|
| 18919 |
+
rxn:2:113564:139579,,
|