smiles stringlengths 11 172 | product_name stringlengths 41 41 | heavy_atoms int64 8 77 |
|---|---|---|
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(CSCC3=CC=CC(=C3)C)=O | 6A14E69639CB7411_7A3554BD9AB4067A_6038_UN | 26 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C5=CC4=C(C(N(C3=C(C=CC(=C3)C)C)C4=O)=O)C=C5)=O | D42775A7D71A3561_383622A74B1AD5D7_6038_UN | 35 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C3=CC4=C(C=C3)C(=O)N(C4=O)C5=CC(=C(C=C5)Cl)Cl | 49C8A652F5BA0AB8_2CFF755335A225F1_6038_UN | 35 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)CN3C(=O)CCC3=O | 6DDE317C12E58CB3_CCC6B946A52090AD_6038_UN | 24 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C3=CC4=C(C=C3)N=N[N]4O | 1C5E05C74DCB4936_B513F304BA4B75DE_6038_UN | 26 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C45CC3(CC(CC(C)(C3)C4)C5)C)=O | FD78A0C2402BC2C1_E675B4133D841245_6038_UN | 28 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C3CCN(CC3)C(=O)C4=CC=C(C=C4)F | FE30B7F1224488BF_C137921B78883337_6038_UN | 31 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C4CN(CC3=CC=C(C)C=C3)C(C4)=O)=O | C3E75B29D0EEEDDD_00EB7FF15F337B68_6038_UN | 30 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C4(O)N(CC3=CC=CC=C3)C(=NC5=C4C=CC=C5)S | 8C21C9EDAEF371ED_1D1C9E77909B3976_6038_UN | 35 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C4CN(C3=CC=C(C)C=C3)C(C4)=O)=O | 56CC2A0EA591A35F_A8CF69884D6783AC_6038_UN | 29 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C4CN(C3=CC=C(CC)C=C3)C(C4)=O)=O | 2E2F1CA8ED710CE9_DC0E5E3C91B7D120_6038_UN | 30 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C4=C(N3CCC(C)CC3)C=CC(=C4)[N](=O)=O)=O | DB7E78C8C81E6A82_D78664A52C936C6D_6038_UN | 32 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=CC=CC(=C3)[S](N(C)C4CCCCC4)(=O)=O)=O | 271F268747761809_192E1AED74595E27_6038_UN | 33 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)CC3=CC4=C(C=C3)OCCO4 | E28929F6CE485242_C1896484BE1A766D_6038_UN | 27 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(CSC(C)(C)C)=O | AE132EDEBEBB3AED_CF55DEDB6F925FCE_6038_UN | 22 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C5=CC3=C(C4=C(OC3)C=CC=C4)S5 | DB0FEF1F21F2074C_34B7C6FA39DEC053_6038_UN | 29 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)CCCCCN[S](=O)(=O)C3=CC4=C(C=C3)OCCO4 | 17E6DD67843C2BD3_77E1679799E33A87_6038_UN | 35 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)CSCC5=NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)N5 | 3F6E156169D9CD47_305587D702FD4FE6_6038_UN | 35 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=C(C=CC(=C3)C)[N](=O)=O)=O | DA4AAA3C3B7A5C97_ABE8F9CB2B1CF375_6038_UN | 26 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(CCC(N(C3=C(N(CCC)C(NC3=O)=O)N)CCOC)=O)=O | 7CC7BB59E16B3B34_01CD6AB85FA56857_6038_UN | 37 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C4=C3C=CC=CC3=CC=N4 | AA982C8BCD0498DA_DE39F3547273D647_6038_UN | 26 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(CCN(C3=CC=C(OC)C=C3)[S](=O)(=O)C4=C(C=C(C=C4)C)C)=O | FFD206B7FA3D8F9E_08FE3A439D688E5D_6038_UN | 38 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(CCC4=NC3=C(C=CC(=C3)[S](N(CC)CC)(=O)=O)[N]4C)=O | 49A26F565B804DC8_EF693B7B3171186C_6038_UN | 36 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C5=C(OCC3=C(ON=C3C)C)C=C4C=CC=CC4=C5)=O | C2C692F3B17B5A1E_73255624829EC35B_6038_UN | 35 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=CC=C([S](C)(=O)=O)C=C3)=O | 3A1218961D0A7DC3_7CEB2602149F12EE_6038_UN | 26 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3CC4=C(CN3[S](CC)(=O)=O)C=CC=C4)=O | B80554079093EE09_A7D30D36E1C47BCD_6038_UN | 31 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=CC(=NC4=C3C=N[N]4C(C)C)C5=CC=CC=C5)=O | A098C12D32980778_4CF4FD829DFE6C07_6038_UN | 34 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C3=CC(=CC=C3)[N]4C=NN=N4 | E32C0E88FCB26BDF_7544914B9D7F2472_6038_UN | 27 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C4=CC=C(N[S](C3=CC=C(C(C)=O)C=C3)(=O)=O)C=C4)=O | 8146D381A12142CF_B9E9E81917601AAC_6038_UN | 35 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C(C)SC3=CC=CC=C3)=O | A25EABB944BBDFEB_19F80EAFACB2EAAA_6038_UN | 25 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(CCC(N(CCCCC)C3=C(N)N(CCCC)C(=O)NC3=O)=O)=O | 79514DD596758B8B_EFD73F6C2801CB7A_6038_UN | 39 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(CSC3=NC4=C([N]3C)C=CC=C4)=O | 381B5D2916584188_1CF51BFFA296D619_6038_UN | 28 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C3CC4CCCC(C3)C4=O | AE8808A0AFE16D7F_90C74A704F590C0B_6038_UN | 26 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C(C)N[S](=O)(=O)C3=CC=CC=C3)=O | 401C7832C62E2889_830A5BA99F8F1411_6038_UN | 28 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)CCC(=O)C3=CC4=C(C=C3)OCCO4 | D97DD45B99939D9E_95195AB26C03D192_6038_UN | 30 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C(CC)N=C3C=C(OC4=C3C=C(C=C4)C)C5=CC(=C(C=C5)OC)OC)=O | 2A7B134051A2D51F_F12D1F4208B4665C_6038_UN | 41 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=NN(CCCC)C(C=C3)=O)=O | 5B7A79DBA86290AE_3ECFFA8C30DF1193_6038_UN | 27 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=C(OC)C=CC(=C3)[S](=O)(=O)N)=O | FF444E0DAC2B8913_308AD26B5537D791_6038_UN | 28 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C3=C(C4=C(O3)C=CC=C4)CSC5CCCCC5 | 21FDF079AD0AF377_6868743901EB439C_6038_UN | 33 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C(=CC3=C([N](CC(C)C)C(=C3)C)C)C#N)=O | C3EE4D44E973E4F8_17B1FEDA1DD3099C_6038_UN | 31 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C4=C([S](N3CCCCC3C)(=O)=O)C=CC=C4)=O | C81B3E64A987FE55_D735FC98AF0E1AED_6038_UN | 32 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C4CN(C3=C(OCC)C=CC=C3)C(C4)=O)=O | C6A3B9594538957A_2DC8A09200C73DC5_6038_UN | 31 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3(CCN(C(C)=O)CC3)C4=CC=CC=C4)=O | 7127ACDD0772BE8D_C60982A82F3FFE6B_6038_UN | 31 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=C(N(CC)CC)C=CC(=C3)[N](=O)=O)=O | 56197707EAFA6F42_0C2E3D7645D90084_6038_UN | 30 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C3=CC=C(C=C3)N4C(SC(=N4)S)=S | 872234A85FF2259B_6E63304721B72A44_6038_UN | 29 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(CCC3=NC(=O)C4=C(N3C)C=CC=C4)=O | 3B416288B782F4DC_1B6E037CD0CB844B_6038_UN | 30 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=CC(=C(OC)C=C3)[S](=O)(=O)N4CCCCC4C)=O | 7A5EFC4931D00B27_B6F8AB9743D8968E_6038_UN | 34 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C4=CC(=C(SC3=NC(=CS3)C)C=C4)[N](=O)=O)=O | 042AE39728959DF7_75721C78FBCF4E9B_6038_UN | 32 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=CC(=C(SC)C=C3)[N](=O)=O)=O | 18557C70AA524692_C97CFF0B50038392_6038_UN | 27 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C4=C(SC3=CC(=C(C)C=C3)C)N=CC=C4)=O | 2DE147131C5C730A_3D66BDEC097BC7A4_6038_UN | 31 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(CCC(C3=C(C)SC(=C3)C)=O)=O | 44D2BF69D77E7076_9DA3AABCF93957BE_6038_UN | 27 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(CC4=CC=C(OCC3=C(ON=C3C)C)C=C4)=O | 3C1C1F4DAB095B9D_11B4A4553A7BFA13_6038_UN | 32 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=C([N](N=C3C)CC4=CC=CC=C4)C)=O | C32F2A02B539D906_17AF6AA1388F1647_6038_UN | 30 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)CN[S](=O)(=O)C3=C(C(=C(C=C3)F)F)F | DD6F399431BB94E5_AFBDC63D6D69C940_6038_UN | 30 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)CSC4=NN=C5N(CC=C)C(=O)C3=C(C=CC=C3)[N]45 | 1E2180D80F757E6B_EA98ED3AFF251ECA_6038_UN | 35 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=CC(=NC4=C3C=C(C)C=C4)C)=O | 642AA818F344FA62_68515989B55DCEF2_6038_UN | 28 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C3=C(C4=C(O3)C=CC=C4)CSC5=NN=C[NH]5 | 499D0A10AE56134B_F03BF3BE987CE648_6038_UN | 32 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C4=C(CSC3=NC(=CS3)C)C=CC=C4)=O | EB7B20C44564F764_684EB305CBE537E4_6038_UN | 30 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C3=CC=C(C=C3)CSC5=NC4=C(C=CC=C4)S5 | 538F345B4810A065_E67FE2A2F7D5C81B_6038_UN | 33 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C4=CC=C(CSC3=NC(=CS3)C)C=C4)=O | AD626E12AA15164D_4D6337CA447979BA_6038_UN | 30 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(COC3=C(OC)C=C(C=C3)C)=O | A7E731E1E1FC00E8_44B84637C74938D8_6038_UN | 27 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=CC=CC(=C3)[S](N(C)CCC#N)(=O)=O)=O | 363E2E1F8E706C19_A37AEE2290CD6E0E_6038_UN | 31 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C4=C(OCC3=CC=CC(=C3)C)C=CC=C4)=O | 92D95172DB31C6FB_4AFC418167CF6426_6038_UN | 31 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C4=CC(=C(N3CCN(C)CC3)C=C4)[N](=O)=O)=O | B457BC56F322EE5C_D29F4F68C04C2AE2_6038_UN | 32 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(CSCC3=CC=C(C)C=C3)=O | 08BC3E5C50156A7E_EB4FA46414DF36BF_6038_UN | 26 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=NN(C(C)C)C(C4=C3C=CC=C4)=O)=O | 214970E1DFA8A9EF_33CDFE6776B85AA6_6038_UN | 30 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C3=C(C=CC=C3)SCC(=O)C4=CC=C(C=C4)C5=CC=CC=C5 | AA222D22425CCB8E_58EF3F92BD486EF0_6038_UN | 38 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C3=CC(=CC=C3)CN4CCCC4 | 8A01D1CE6B1A4751_CAC013CDC9E03C20_6038_UN | 28 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)CCN4N=NC3=C(C=CC=C3)C4=O | 0361904B8B1982E6_DD2817421A1B56B4_6038_UN | 29 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(CCC3=NC4=C([N]3CC)C=CC(=C4)[S](=O)(=O)N(C)C)=O | 97793150115100C3_74F49312D0CC3162_6038_UN | 35 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C3CN(C(=O)C3)C5=C4C=CC=CC4=CC=C5 | EE796C4B1DD7209B_5F38605C5AAAA9AE_6038_UN | 32 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=C([S](C)=O)C=CC=C3)=O | 38F61DDB057F22F0_432471539381E35D_6038_UN | 25 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C5=CC4=CC3=C(C=C(OC)C=C3)N=C4S5)=O | 513A76AED82702D0_98A461A9AAF35802_6038_UN | 31 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=CC=C(CC)S3)=O | B364193FA06CD759_DDAD3D59CF057C24_6038_UN | 23 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C(=CC3=C[N](CCC#N)N=C3C4=CC(=C(C=C4)F)F)C#N | 8B0399887A13DF22_AF3C348D7F2447CE_6038_UN | 37 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)CC3=CC(=O)N(N3)C4CC[S](=O)(=O)C4 | 887C4D985AF53F05_E68A56FB7540E129_6038_UN | 30 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C3=C(C=CC=C3)CC#N | A794C825464311F8_B48E31A5FAA3CF38_6038_UN | 25 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=CC(=NC4=C3C=CC=C4)C(C)C)=O | 47725D5D35386DEB_178CE53B87DE7572_6038_UN | 29 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C3=C(C=CS3)[N]4C=CC=C4 | 21DA8532AAB73846_227DACB4AA32DBF0_6038_UN | 26 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C3=CC(=CC=C3)[S](=O)(=O)F | 4AE1D43A0A2A31DD_C8A5DD7F085EAFF7_6038_UN | 26 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)CC[N]3C=NC=N3 | 81598D96AB37851A_038ACE09EADD1D44_6038_UN | 23 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=CC(=C[N]3C)C(C)=O)=O | A8F91D0EE7631D96_60AFCDDA08FB1FED_6038_UN | 25 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C3=CC(=O)N(N3)C4=CC=CC=C4 | 9053B71D70972B5F_FE42CFA52546F32A_6038_UN | 28 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)CC3=CSC4=NC(=C[N]34)C5=CC=CS5 | D68464010025CD09_0F90C14C3BE6C92A_6038_UN | 30 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C4=CC3=C(C=C(OC)C=C3)N=C4C)=O | EE0B83064C4CF21E_219C262BC3D1CD11_6038_UN | 29 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C4=CC3=C(C)C=CC=C3[NH]4)=O | EB8901C128589681_7E57A2C1DD2B93C8_6038_UN | 26 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=CC(=NC4=C3C=N[N]4C(C)C)C5=C(SC(=C5)C)C)=O | 3649412EAE0CBEF1_DF0AFF5A76D77321_6038_UN | 35 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C3=C(C=CC(=C3)[N](=O)=O)SC4=C(C=CC=C4)F | A970447718D186EF_5E12EC983C6DFD11_6038_UN | 33 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3CC(N(C)C4=C3C=CC=C4)=O)=O | 333BBD58E850A267_C05AF2DBF9C35692_6038_UN | 28 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C(C)N4C(=C)C3=C(C=CC=C3)C4=O)=O | 4167985D6326EE4A_32523FD9B3CFDCC6_6038_UN | 29 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C3=CC=C(C=C3)CN[S](=O)(=O)C4=CC(=C(C=C4)F)Cl | 1458438FBC00B8AE_B03DC6BE56E885B1_6038_UN | 35 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C4=C(SCC3=CC(=NO3)C)C=CC=C4)=O | CA211D2F492AD768_CFD61EE2C8117239_6038_UN | 30 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)CC[N]3C=CN=C3 | 3A4CC9B1C892AD6F_A3CE0A695B2A7FD8_6038_UN | 23 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)CC3=NC=CC=C3 | D9E0B0CB16B67D68_8DB55DAB718BA067_6038_UN | 23 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)CCN3N=CC(=O)C4=C3C=CC=C4 | CDCDCC0F143817FB_AF0549F1E6DAA048_6038_UN | 29 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=CC(=C[N]3C)[S](=O)(=O)N)=O | AA4DC38D932C8FBC_A5B1A2E1111D0461_6038_UN | 26 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)CN[S](=O)(=O)C3=CC=C(C=C3)F | F54409A48EB4CA96_E1670D2E85803FCC_6038_UN | 28 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C3=CC(=CC=C3)[S](=O)(=O)NCC4=CN=CC=C4 | FD5C4533B5750EA4_9003FF3B6BB771FE_6038_UN | 33 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C4=CC3=C(C=CC(=C3)OC)N=C4C)=O | 085F341B8EA97D32_C6FA6BC7A0BFD897_6038_UN | 29 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)CN4C(=O)CC3=C(C=CC=C3)C4=O | ED9F4F0BE1EF216F_F70739FA45F0E4CC_6038_UN | 29 |
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