117831 -OEChem-06181322482D 93 95 0 0 0 0 0 0 0999 V2000 10.6603 -6.1900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 -6.1900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -8.1900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -5.1900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -8.1900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -3.6900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -4.6900 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 3.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 4.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -1.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 5.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -2.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 5.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -3.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 6.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -3.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 7.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 8.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -5.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -5.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 8.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -4.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -4.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -6.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 -5.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -5.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -6.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -3.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 -4.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -6.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 -3.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 -3.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1523 -5.2247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1523 -3.1553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -7.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -4.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0583 -4.7108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0583 -3.6692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7196 1.4177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1181 0.7274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9407 2.2023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5422 2.8926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8067 0.7023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4082 1.3926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8535 2.9177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2520 2.2274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5856 -0.0823 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9841 -0.7726 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0747 3.7023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6762 4.3926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6728 -0.7977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2742 -0.1074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9875 4.4177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3860 3.7274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4516 -1.5823 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8501 -2.2726 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2087 5.2023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8101 5.8926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5388 -2.2977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1403 -1.6074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1215 5.9177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 5.2274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3176 -3.0823 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7162 -3.7726 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3426 6.7023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9441 7.3926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4048 -3.7977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0063 -3.1074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 7.4177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 6.7274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4766 8.2023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0781 8.8926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 9.3469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 9.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 8.2731 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -4.0700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -6.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9893 -3.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6592 -6.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 -2.5700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1451 -5.8446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1451 -2.5354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9292 -6.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5941 -5.0229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5941 -3.3571 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -8.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 -4.8800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 26 2 0 0 0 0 2 31 1 0 0 0 0 2 89 1 0 0 0 0 3 41 1 0 0 0 0 3 92 1 0 0 0 0 4 42 1 0 0 0 0 4 93 1 0 0 0 0 5 41 2 0 0 0 0 6 42 2 0 0 0 0 7 22 1 0 0 0 0 7 25 1 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 45 1 0 0 0 0 8 46 1 0 0 0 0 9 11 1 0 0 0 0 9 47 1 0 0 0 0 9 48 1 0 0 0 0 10 12 1 0 0 0 0 10 49 1 0 0 0 0 10 50 1 0 0 0 0 11 13 1 0 0 0 0 11 51 1 0 0 0 0 11 52 1 0 0 0 0 12 14 1 0 0 0 0 12 53 1 0 0 0 0 12 54 1 0 0 0 0 13 15 1 0 0 0 0 13 55 1 0 0 0 0 13 56 1 0 0 0 0 14 16 1 0 0 0 0 14 57 1 0 0 0 0 14 58 1 0 0 0 0 15 17 1 0 0 0 0 15 59 1 0 0 0 0 15 60 1 0 0 0 0 16 18 1 0 0 0 0 16 61 1 0 0 0 0 16 62 1 0 0 0 0 17 19 1 0 0 0 0 17 63 1 0 0 0 0 17 64 1 0 0 0 0 18 20 1 0 0 0 0 18 65 1 0 0 0 0 18 66 1 0 0 0 0 19 21 1 0 0 0 0 19 67 1 0 0 0 0 19 68 1 0 0 0 0 20 22 1 0 0 0 0 20 69 1 0 0 0 0 20 70 1 0 0 0 0 21 23 1 0 0 0 0 21 71 1 0 0 0 0 21 72 1 0 0 0 0 22 73 1 0 0 0 0 22 74 1 0 0 0 0 23 24 1 0 0 0 0 23 75 1 0 0 0 0 23 76 1 0 0 0 0 24 27 1 0 0 0 0 24 77 1 0 0 0 0 24 78 1 0 0 0 0 25 29 2 0 0 0 0 25 30 1 0 0 0 0 26 28 1 0 0 0 0 27 79 1 0 0 0 0 27 80 1 0 0 0 0 27 81 1 0 0 0 0 28 31 2 0 0 0 0 28 34 1 0 0 0 0 29 32 1 0 0 0 0 29 82 1 0 0 0 0 30 33 2 0 0 0 0 30 83 1 0 0 0 0 31 35 1 0 0 0 0 32 36 2 0 0 0 0 32 42 1 0 0 0 0 33 36 1 0 0 0 0 33 41 1 0 0 0 0 34 38 2 0 0 0 0 34 84 1 0 0 0 0 35 37 1 0 0 0 0 35 39 2 0 0 0 0 36 85 1 0 0 0 0 37 38 1 0 0 0 0 37 40 2 0 0 0 0 38 86 1 0 0 0 0 39 43 1 0 0 0 0 39 87 1 0 0 0 0 40 44 1 0 0 0 0 40 88 1 0 0 0 0 43 44 2 0 0 0 0 43 90 1 0 0 0 0 44 91 1 0 0 0 0 M END > 117831 > 1 > 826 > 6 > 3 > 21 > AAADcfB+OAAAAAAAAAAAAAAAAAAAAAAAAAAwYMAAAAAAAADBVAAAHgAACAAADAzBmAQyzsMAAgCIAiXSWACCAAAlIgAIiAEMbMgIJjbClZOEcUhm5hHI2Ye87vCOwAADQAAYAACAAAaAADAAAAAAAAAAAA== > 5-[(1-hydroxynaphthalene-2-carbonyl)-octadecyl-amino]benzene-1,3-dicarboxylic acid > 5-[[(1-hydroxy-2-naphthalenyl)-oxomethyl]-octadecylamino]benzene-1,3-dicarboxylic acid > 5-[(1-hydroxynaphthalene-2-carbonyl)-octadecylamino]benzene-1,3-dicarboxylic acid > 5-[octadecyl-(1-oxidanylnaphthalen-2-yl)carbonyl-amino]benzene-1,3-dicarboxylic acid > 5-[(1-hydroxy-2-naphthoyl)-stearyl-amino]isophthalic acid > InChI=1S/C37H49NO6/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-24-38(31-26-29(36(41)42)25-30(27-31)37(43)44)35(40)33-23-22-28-20-17-18-21-32(28)34(33)39/h17-18,20-23,25-27,39H,2-16,19,24H2,1H3,(H,41,42)(H,43,44) > OBCOPYLXZAHBGX-UHFFFAOYSA-N > 12.3 > 603.355988 > C37H49NO6 > 603.78806 > CCCCCCCCCCCCCCCCCCN(C1=CC(=CC(=C1)C(=O)O)C(=O)O)C(=O)C2=C(C3=CC=CC=C3C=C2)O > CCCCCCCCCCCCCCCCCCN(C1=CC(=CC(=C1)C(=O)O)C(=O)O)C(=O)C2=C(C3=CC=CC=C3C=C2)O > 115 > 603.355988 > 0 > 44 > 0 > 0 > 0 > 0 > 0 > 1 > 3 > 1 5 255 > 25 29 8 25 30 8 28 31 8 28 34 8 29 32 8 30 33 8 31 35 8 32 36 8 33 36 8 34 38 8 35 37 8 35 39 8 37 38 8 37 40 8 39 43 8 40 44 8 43 44 8 $$$$