10405368 -OEChem-04262422432D 63 64 0 1 0 0 0 0 0999 V2000 6.3301 2.0670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.0670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 4.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 3.0670 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4641 3.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 5.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 4.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9641 5.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4641 4.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5981 -0.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 -0.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -5.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 2.7570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6762 2.9844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0747 3.6746 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9966 5.5419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1996 5.5419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1215 3.6746 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 2.9844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 5.1496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1215 4.4593 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5010 5.1230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2741 5.9700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4272 5.7430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4641 3.9470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0841 4.5670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4641 5.1870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8101 -2.5156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2087 -1.8254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 0.2570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 0.2570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 -1.8504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1215 -2.5407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5981 -0.3130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9781 -0.9330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5981 -1.5530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 -1.5530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2181 -0.9330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 -0.3130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9441 -4.0156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3426 -3.3254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 1.7570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 1.7570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 -3.3504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 -4.0407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0781 -5.5156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4766 -4.8254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -4.8961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -5.7430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -5.9700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 55 1 0 0 0 0 2 14 1 0 0 0 0 2 56 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 3 9 1 0 0 0 0 3 10 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 4 11 1 0 0 0 0 4 26 1 0 0 0 0 5 27 1 0 0 0 0 5 28 1 0 0 0 0 6 8 1 0 0 0 0 6 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 12 15 1 0 0 0 0 12 16 1 0 0 0 0 12 20 1 0 0 0 0 12 21 1 0 0 0 0 13 17 1 0 0 0 0 14 18 2 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 16 19 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 43 1 0 0 0 0 18 44 1 0 0 0 0 19 22 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 21 50 1 0 0 0 0 21 51 1 0 0 0 0 21 52 1 0 0 0 0 22 23 1 0 0 0 0 22 53 1 0 0 0 0 22 54 1 0 0 0 0 23 24 1 0 0 0 0 23 57 1 0 0 0 0 23 58 1 0 0 0 0 24 25 1 0 0 0 0 24 59 1 0 0 0 0 24 60 1 0 0 0 0 25 61 1 0 0 0 0 25 62 1 0 0 0 0 25 63 1 0 0 0 0 M END > 10405368 > 1 > 389 > 2 > 2 > 7 > AAADcfB4MAAAAAAAAAAAAAAAAAAAAAAAAAAwYAAAAAAAAAABAAAAGgAACAAADwSAmAAyBoAAAgCAAiBCAAACAAAgIAAAiAAGCIgIJyKCERKAcAAlwBUImAeA4PQPwAABCAAIAACAAAYQABAAAAAAAAAAAA== > 2-(3,3-dimethylcyclohexyl)-5-(1,1-dimethylheptyl)benzene-1,3-diol > 2-(3,3-dimethylcyclohexyl)-5-(2-methyloctan-2-yl)benzene-1,3-diol > 2-(3,3-dimethylcyclohexyl)-5-(2-methyloctan-2-yl)benzene-1,3-diol > 2-(3,3-dimethylcyclohexyl)-5-(2-methyloctan-2-yl)benzene-1,3-diol > 2-(3,3-dimethylcyclohexyl)-5-(2-methyloctan-2-yl)benzene-1,3-diol > 2-(3,3-dimethylcyclohexyl)-5-(1,1-dimethylheptyl)resorcinol > InChI=1S/C23H38O2/c1-6-7-8-9-13-23(4,5)18-14-19(24)21(20(25)15-18)17-11-10-12-22(2,3)16-17/h14-15,17,24-25H,6-13,16H2,1-5H3 > WBSPBIRKSHKQQD-UHFFFAOYSA-N > 8.8 > 346.287180451 > C23H38O2 > 346.5 > CCCCCCC(C)(C)C1=CC(=C(C(=C1)O)C2CCCC(C2)(C)C)O > CCCCCCC(C)(C)C1=CC(=C(C(=C1)O)C2CCCC(C2)(C)C)O > 40.5 > 346.287180451 > 0 > 25 > 0 > 1 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 11 13 8 11 14 8 13 17 8 14 18 8 15 17 8 15 18 8 4 11 3 $$$$