70607300 -OEChem-05052422252D 102103 0 1 0 0 0 0 0999 V2000 14.6244 2.7010 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.6244 2.7010 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.8564 -0.1651 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 2.8349 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -0.1651 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.1244 1.8349 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 13.2583 1.3349 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 16.1244 3.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1244 3.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9904 1.3349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6244 2.7010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6244 4.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 0.3349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 1.8349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9904 0.3349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6244 4.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1244 -0.1651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7224 -2.6651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5885 -3.1651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7224 -1.6651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.1244 5.2990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5885 -4.1651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8564 -1.1651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 1.3349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4545 -4.6651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.1651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.1244 5.2990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.3349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.3349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.1651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.1651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4545 -5.6651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 0.3349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 1.8349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 0.3349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.3349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.6244 6.1651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 0.3349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -0.1651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 1.3349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3205 -6.1651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.1651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 1.9549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2320 4.1776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5417 3.7790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0167 2.9564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.7070 3.3549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5273 1.6449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5167 2.0904 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2070 2.4889 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.7320 5.0436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0417 4.6451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7214 0.0249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.5167 3.8224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2070 4.2210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1244 -0.7851 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1119 -2.5574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5104 -3.2477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1990 -3.2727 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8005 -2.5824 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3330 -1.7727 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9345 -1.0824 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2320 5.9096 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.5417 5.5111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9779 -4.0574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3764 -4.7477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2458 -1.0574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6444 -1.7477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9344 3.2379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.0651 -4.7727 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.6665 -4.0824 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0656 -0.6400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8626 -0.6400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7287 0.8099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9316 0.8099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.0167 4.6885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.7070 5.0870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9966 0.8099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1996 0.8099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7976 -0.6400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5947 -0.6400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3335 -0.6400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1306 -0.6400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8439 -5.5574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2424 -6.2477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 0.0249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 2.4549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4607 0.8099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6636 0.8099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2646 0.8099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4675 0.8099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.1613 5.8551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.9344 6.7020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.0874 6.4751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -0.7851 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2573 1.6449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.0105 -6.7020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.8574 -6.4751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.6305 -5.6281 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 0.3719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.4751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -0.7020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 6 1 0 0 0 0 1 11 1 0 0 0 0 2 6 1 0 0 0 0 2 69 1 0 0 0 0 3 15 1 0 0 0 0 3 23 1 0 0 0 0 4 14 2 0 0 0 0 5 35 1 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 13 1 0 0 0 0 7 14 1 0 0 0 0 7 43 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 8 44 1 0 0 0 0 8 45 1 0 0 0 0 9 12 1 0 0 0 0 9 46 1 0 0 0 0 9 47 1 0 0 0 0 10 15 2 0 0 0 0 10 48 1 0 0 0 0 11 49 1 0 0 0 0 11 50 1 0 0 0 0 12 16 1 0 0 0 0 12 51 1 0 0 0 0 12 52 1 0 0 0 0 13 17 2 0 0 0 0 13 53 1 0 0 0 0 14 24 1 0 0 0 0 15 17 1 0 0 0 0 16 21 1 0 0 0 0 16 54 1 0 0 0 0 16 55 1 0 0 0 0 17 56 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 57 1 0 0 0 0 18 58 1 0 0 0 0 19 22 1 0 0 0 0 19 59 1 0 0 0 0 19 60 1 0 0 0 0 20 23 1 0 0 0 0 20 61 1 0 0 0 0 20 62 1 0 0 0 0 21 27 1 0 0 0 0 21 63 1 0 0 0 0 21 64 1 0 0 0 0 22 25 1 0 0 0 0 22 65 1 0 0 0 0 22 66 1 0 0 0 0 23 67 1 0 0 0 0 23 68 1 0 0 0 0 24 33 2 0 0 0 0 24 34 1 0 0 0 0 25 32 1 0 0 0 0 25 70 1 0 0 0 0 25 71 1 0 0 0 0 26 28 1 0 0 0 0 26 29 1 0 0 0 0 26 72 1 0 0 0 0 26 73 1 0 0 0 0 27 37 1 0 0 0 0 27 76 1 0 0 0 0 27 77 1 0 0 0 0 28 30 1 0 0 0 0 28 74 1 0 0 0 0 28 75 1 0 0 0 0 29 31 1 0 0 0 0 29 78 1 0 0 0 0 29 79 1 0 0 0 0 30 35 1 0 0 0 0 30 80 1 0 0 0 0 30 81 1 0 0 0 0 31 36 1 0 0 0 0 31 82 1 0 0 0 0 31 83 1 0 0 0 0 32 41 1 0 0 0 0 32 84 1 0 0 0 0 32 85 1 0 0 0 0 33 39 1 0 0 0 0 33 86 1 0 0 0 0 34 40 2 0 0 0 0 34 87 1 0 0 0 0 35 88 1 0 0 0 0 35 89 1 0 0 0 0 36 42 1 0 0 0 0 36 90 1 0 0 0 0 36 91 1 0 0 0 0 37 92 1 0 0 0 0 37 93 1 0 0 0 0 37 94 1 0 0 0 0 38 39 2 0 0 0 0 38 40 1 0 0 0 0 39 95 1 0 0 0 0 40 96 1 0 0 0 0 41 97 1 0 0 0 0 41 98 1 0 0 0 0 41 99 1 0 0 0 0 42100 1 0 0 0 0 42101 1 0 0 0 0 42102 1 0 0 0 0 M END > 70607300 > 1 > 738 > 5 > 1 > 26 > AAADcfB8OAAAAAAAAAAAAAAAAAAAAAAAAAAwQAAAAAAAAAABAAAAGgAACAAADQSgmAIyDoAABgCIAqBSAAACCAAkIAAIiAEGCMgcJjaENRqCeSCk4BEMuYeIzODOIAAAAAAAAABAAAAAAAAAAAAAAAAAAA== > (6-hydroxy-4,6-dioctoxy-cyclohexa-2,4-dien-1-yl)-(4-octoxyphenyl)methanone > (6-hydroxy-4,6-dioctoxy-1-cyclohexa-2,4-dienyl)-(4-octoxyphenyl)methanone > (6-hydroxy-4,6-dioctoxycyclohexa-2,4-dien-1-yl)-(4-octoxyphenyl)methanone > (6-hydroxy-4,6-dioctoxycyclohexa-2,4-dien-1-yl)-(4-octoxyphenyl)methanone > (4,6-dioctoxy-6-oxidanyl-cyclohexa-2,4-dien-1-yl)-(4-octoxyphenyl)methanone > (6-hydroxy-4,6-dioctoxy-cyclohexa-2,4-dien-1-yl)-(4-octoxyphenyl)methanone > InChI=1S/C37H60O5/c1-4-7-10-13-16-19-28-40-33-24-22-32(23-25-33)36(38)35-27-26-34(41-29-20-17-14-11-8-5-2)31-37(35,39)42-30-21-18-15-12-9-6-3/h22-27,31,35,39H,4-21,28-30H2,1-3H3 > FUSWRXDWDQLTPE-UHFFFAOYSA-N > 12.3 > 584.44407501 > C37H60O5 > 584.9 > CCCCCCCCOC1=CC=C(C=C1)C(=O)C2C=CC(=CC2(O)OCCCCCCCC)OCCCCCCCC > CCCCCCCCOC1=CC=C(C=C1)C(=O)C2C=CC(=CC2(O)OCCCCCCCC)OCCCCCCCC > 65 > 584.44407501 > 0 > 42 > 0 > 2 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 6 2 3 24 33 8 24 34 8 33 39 8 34 40 8 38 39 8 38 40 8 7 14 3 $$$$