44149770 -OEChem-05052416302D 92 94 0 1 0 0 0 0 0999 V2000 4.4785 5.1200 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.9713 12.9049 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6547 11.7381 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5002 12.6268 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8872 14.5860 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2956 16.3864 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5977 18.2089 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4785 5.1200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4785 5.1200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6125 0.6200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3445 0.6200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0371 17.4574 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4785 6.1200 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4710 16.5564 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4710 16.5564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0945 15.7746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8476 15.7746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8720 14.7996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9710 14.3658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0701 14.7996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8772 13.3284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7416 14.2262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9610 16.1942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4534 14.0370 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7333 12.7350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6718 13.1869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0791 15.7651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6005 18.2836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4726 14.0409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8621 14.8086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3445 6.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6125 6.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1666 19.1846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3445 7.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6125 7.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8850 11.9087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4785 4.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4788 11.1716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3994 13.0641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2105 8.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7464 8.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6125 3.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3445 3.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5925 13.6305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6125 2.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3445 2.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4785 2.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4785 1.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8549 16.6258 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0296 16.8254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3331 17.1609 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6531 15.5056 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4811 16.2593 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4189 17.5037 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2970 14.5017 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9577 16.8142 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7194 13.4769 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2021 13.4830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5566 6.0374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9551 6.7277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0019 6.7277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4004 6.0374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7252 19.4536 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8976 19.7432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6080 18.9156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1325 8.2026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7340 7.5123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2231 7.5123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8245 8.2026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2673 11.9621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8315 11.2910 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5027 11.8552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1275 10.6607 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9897 10.8203 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8300 11.6825 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6706 12.5066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9570 13.3353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1283 13.6217 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5206 7.5831 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7475 8.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9006 8.6569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0564 8.6569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2095 8.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4364 7.5831 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0755 3.9300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8815 3.9300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 13.8132 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4097 13.0380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1849 13.4477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0755 2.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8815 2.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6125 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 2 0 0 0 0 1 9 2 0 0 0 0 1 13 1 0 0 0 0 1 37 1 0 0 0 0 2 21 1 0 0 0 0 2 36 1 0 0 0 0 3 25 1 0 0 0 0 3 38 1 0 0 0 0 4 26 1 0 0 0 0 4 39 1 0 0 0 0 5 30 1 0 0 0 0 5 44 1 0 0 0 0 6 27 2 0 0 0 0 7 28 2 0 0 0 0 10 48 1 0 0 0 0 10 92 1 0 0 0 0 11 48 2 0 0 0 0 14 12 1 1 0 0 0 12 28 1 0 0 0 0 12 54 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 14 49 1 0 0 0 0 15 16 1 0 0 0 0 15 50 1 0 0 0 0 15 51 1 0 0 0 0 16 18 1 0 0 0 0 16 52 1 0 0 0 0 16 53 1 0 0 0 0 17 20 1 0 0 0 0 17 23 2 0 0 0 0 18 19 1 0 0 0 0 18 22 2 0 0 0 0 19 20 1 0 0 0 0 19 21 2 0 0 0 0 20 24 2 0 0 0 0 21 25 1 0 0 0 0 22 26 1 0 0 0 0 22 55 1 0 0 0 0 23 27 1 0 0 0 0 23 56 1 0 0 0 0 24 29 1 0 0 0 0 24 57 1 0 0 0 0 25 26 2 0 0 0 0 27 30 1 0 0 0 0 28 33 1 0 0 0 0 29 30 2 0 0 0 0 29 58 1 0 0 0 0 31 34 1 0 0 0 0 31 59 1 0 0 0 0 31 60 1 0 0 0 0 32 35 1 0 0 0 0 32 61 1 0 0 0 0 32 62 1 0 0 0 0 33 63 1 0 0 0 0 33 64 1 0 0 0 0 33 65 1 0 0 0 0 34 40 1 0 0 0 0 34 66 1 0 0 0 0 34 67 1 0 0 0 0 35 41 1 0 0 0 0 35 68 1 0 0 0 0 35 69 1 0 0 0 0 36 70 1 0 0 0 0 36 71 1 0 0 0 0 36 72 1 0 0 0 0 37 42 2 0 0 0 0 37 43 1 0 0 0 0 38 73 1 0 0 0 0 38 74 1 0 0 0 0 38 75 1 0 0 0 0 39 76 1 0 0 0 0 39 77 1 0 0 0 0 39 78 1 0 0 0 0 40 79 1 0 0 0 0 40 80 1 0 0 0 0 40 81 1 0 0 0 0 41 82 1 0 0 0 0 41 83 1 0 0 0 0 41 84 1 0 0 0 0 42 45 1 0 0 0 0 42 85 1 0 0 0 0 43 46 2 0 0 0 0 43 86 1 0 0 0 0 44 87 1 0 0 0 0 44 88 1 0 0 0 0 44 89 1 0 0 0 0 45 47 2 0 0 0 0 45 90 1 0 0 0 0 46 47 1 0 0 0 0 46 91 1 0 0 0 0 47 48 1 0 0 0 0 M END > 44149770 > 1 > 1110 > 11 > 2 > 12 > AAADcfB/PABAAAAAAAAAAAAAAAAAAAAAAAAwYAAABggAAAABQAAAHgQQSAAADCzB2AYyD4LABgKIAqHSGHLCCBAkIAAIiJlOiMgNJzKEtR6EcSIl1hWKuYeY+P+OsAABCAAYQABgAAIQADCAAAAAAAAAAA== > 4-(dipropylsulfamoyl)benzoic acid;N-[(7S)-1,2,3,10-tetramethoxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]acetamide > 4-(dipropylsulfamoyl)benzoic acid;N-[(7S)-1,2,3,10-tetramethoxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]acetamide > 4-(dipropylsulfamoyl)benzoic acid;N-[(7S)-1,2,3,10-tetramethoxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]acetamide > 4-(dipropylsulfamoyl)benzoic acid;N-[(7S)-1,2,3,10-tetramethoxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]acetamide > 4-(dipropylsulfamoyl)benzoic acid;N-[(7S)-1,2,3,10-tetramethoxy-9-oxidanylidene-6,7-dihydro-5H-benzo[a]heptalen-7-yl]ethanamide > 4-(dipropylsulfamoyl)benzoic acid;N-[(7S)-9-keto-1,2,3,10-tetramethoxy-6,7-dihydro-5H-benzo[a]heptalen-7-yl]acetamide > InChI=1S/C22H25NO6.C13H19NO4S/c1-12(24)23-16-8-6-13-10-19(27-3)21(28-4)22(29-5)20(13)14-7-9-18(26-2)17(25)11-15(14)16;1-3-9-14(10-4-2)19(17,18)12-7-5-11(6-8-12)13(15)16/h7,9-11,16H,6,8H2,1-5H3,(H,23,24);5-8H,3-4,9-10H2,1-2H3,(H,15,16)/t16-;/m0./s1 > WFUGJIWKCBYGJL-NTISSMGPSA-N > 684.27166678 > C35H44N2O10S > 684.8 > CCCN(CCC)S(=O)(=O)C1=CC=C(C=C1)C(=O)O.CC(=O)NC1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)OC)OC)OC)OC > CCCN(CCC)S(=O)(=O)C1=CC=C(C=C1)C(=O)O.CC(=O)N[C@H]1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)OC)OC)OC)OC > 166 > 684.27166678 > 0 > 48 > 1 > 0 > 0 > 0 > 0 > 2 > 2 > 1 5 255 > 14 12 5 17 20 8 17 23 8 18 19 8 18 22 8 19 21 8 20 24 8 21 25 8 22 26 8 23 27 8 24 29 8 25 26 8 27 30 8 29 30 8 37 42 8 37 43 8 42 45 8 43 46 8 45 47 8 46 47 8 $$$$