12788255 -OEChem-03292410092D 63 64 0 1 0 0 0 0 0999 V2000 6.0010 5.6900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 2.6900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 3.6900 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.1350 4.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 4.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 5.1900 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4030 5.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 5.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 2.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 0.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 2.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 2.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 1.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2690 -0.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2690 -0.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 1.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -3.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -4.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -4.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -5.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -6.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0051 3.2650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3471 3.6074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7456 4.2977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7924 4.2977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1909 3.6074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 5.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1909 5.7726 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7924 5.0823 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6675 6.1650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8705 6.1650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6584 -1.2023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0569 -1.8926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7456 -1.9177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3471 -1.2274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6720 2.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2690 -0.9300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8890 -0.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2690 0.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2690 0.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6490 -0.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2690 -0.9300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.8800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6720 0.8800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5244 -2.7023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9230 -3.3926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 6.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6116 -3.4177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2131 -2.7274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3905 -4.2023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7890 -4.8926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4776 -4.9177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0791 -4.2274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2565 -5.7023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6550 -6.3926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4231 -6.8469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2700 -6.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0431 -5.7731 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6 1 1 6 0 0 0 1 51 1 0 0 0 0 2 14 1 0 0 0 0 2 58 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 10 1 0 0 0 0 3 26 1 1 0 0 0 4 6 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 7 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 6 8 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 9 17 1 0 0 0 0 9 18 1 0 0 0 0 10 14 2 0 0 0 0 10 15 1 0 0 0 0 11 13 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 16 2 0 0 0 0 12 19 1 0 0 0 0 13 20 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 16 1 0 0 0 0 15 19 2 0 0 0 0 15 40 1 0 0 0 0 16 47 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 20 49 1 0 0 0 0 20 50 1 0 0 0 0 21 22 1 0 0 0 0 21 52 1 0 0 0 0 21 53 1 0 0 0 0 22 23 1 0 0 0 0 22 54 1 0 0 0 0 22 55 1 0 0 0 0 23 24 1 0 0 0 0 23 56 1 0 0 0 0 23 57 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 > 12788255 > 1 > 365 > 2 > 2 > 9 > AAADcfB4MAAAAAAAAAAAAAAAAAAAAAAAAAAwYAAAAAAAAAABAAAAGgAACAAADxSgmAIyBoAAAgCAAiBCAAACAAAgIAAIiAAGCIgINiKCERKAcAAkwBEImAeA4PQPwAABAAAIAACAAAIAABAAAAAAAAAAAA== > 5-(1,1-dimethylnonyl)-2-[(1R,3S)-3-hydroxycyclohexyl]phenol > 2-[(1R,3S)-3-hydroxycyclohexyl]-5-(2-methyldecan-2-yl)phenol > 2-[(1R,3S)-3-hydroxycyclohexyl]-5-(2-methyldecan-2-yl)phenol > 2-[(1R,3S)-3-hydroxycyclohexyl]-5-(2-methyldecan-2-yl)phenol > 5-(2-methyldecan-2-yl)-2-[(1R,3S)-3-oxidanylcyclohexyl]phenol > 5-(1,1-dimethylnonyl)-2-[(1R,3S)-3-hydroxycyclohexyl]phenol > InChI=1S/C23H38O2/c1-4-5-6-7-8-9-15-23(2,3)19-13-14-21(22(25)17-19)18-11-10-12-20(24)16-18/h13-14,17-18,20,24-25H,4-12,15-16H2,1-3H3/t18-,20+/m1/s1 > BIGNODGYJZJTBM-QUCCMNQESA-N > 8.2 > 346.287180451 > C23H38O2 > 346.5 > CCCCCCCCC(C)(C)C1=CC(=C(C=C1)C2CCCC(C2)O)O > CCCCCCCCC(C)(C)C1=CC(=C(C=C1)[C@@H]2CCC[C@@H](C2)O)O > 40.5 > 346.287180451 > 0 > 25 > 2 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 6 1 6 10 14 8 10 15 8 12 16 8 12 19 8 14 16 8 15 19 8 3 26 5 $$$$