70475099 -OEChem-03282416032D 46 48 0 0 0 0 0 0 0999 V2000 4.2690 -1.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -1.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 1.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 1.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9399 -2.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3249 -2.6674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9264 -3.3577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8796 -3.3577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4810 -2.6674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9264 -4.1423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3249 -4.8326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4810 -4.8326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8796 -4.1423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0044 -5.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8015 -5.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6720 -0.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0569 3.3326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6584 2.6423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 4.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 2.1300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5380 1.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 5.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4040 2.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4040 4.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 12 1 0 0 0 0 2 11 2 0 0 0 0 3 17 1 0 0 0 0 3 42 1 0 0 0 0 4 18 1 0 0 0 0 4 43 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 11 1 0 0 0 0 5 25 1 0 0 0 0 6 8 1 0 0 0 0 6 26 1 0 0 0 0 6 27 1 0 0 0 0 7 9 1 0 0 0 0 7 28 1 0 0 0 0 7 29 1 0 0 0 0 8 10 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 12 14 2 0 0 0 0 12 15 1 0 0 0 0 13 16 1 0 0 0 0 13 17 2 0 0 0 0 13 18 1 0 0 0 0 14 17 1 0 0 0 0 14 36 1 0 0 0 0 15 18 2 0 0 0 0 15 37 1 0 0 0 0 16 19 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 20 22 1 0 0 0 0 20 40 1 0 0 0 0 21 23 2 0 0 0 0 21 41 1 0 0 0 0 22 24 2 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 24 46 1 0 0 0 0 M END > 70475099 > 1 > 386 > 4 > 2 > 5 > AAADceB4OAAAAAAAAAAAAAAAAAAAAAAAAAAwYMAAAAAAAAABQAAAGgAACAAADQSAmAAwDoAABgCIAiDSCAACCAAgIAAIiAEGCIgMJzKGMRqCeiClwBUIuAeI6OyOIAAACAAIAABAAAAQABAAAAAAAAAAAA== > (4-benzyl-3,5-dihydroxy-phenyl) cyclohexanecarboxylate > cyclohexanecarboxylic acid [3,5-dihydroxy-4-(phenylmethyl)phenyl] ester > (4-benzyl-3,5-dihydroxyphenyl) cyclohexanecarboxylate > (4-benzyl-3,5-dihydroxyphenyl) cyclohexanecarboxylate > [3,5-bis(oxidanyl)-4-(phenylmethyl)phenyl] cyclohexanecarboxylate > cyclohexanecarboxylic acid (4-benzyl-3,5-dihydroxy-phenyl) ester > InChI=1S/C20H22O4/c21-18-12-16(24-20(23)15-9-5-2-6-10-15)13-19(22)17(18)11-14-7-3-1-4-8-14/h1,3-4,7-8,12-13,15,21-22H,2,5-6,9-11H2 > OBZTYGJCPMQACU-UHFFFAOYSA-N > 5 > 326.15180918 > C20H22O4 > 326.4 > C1CCC(CC1)C(=O)OC2=CC(=C(C(=C2)O)CC3=CC=CC=C3)O > C1CCC(CC1)C(=O)OC2=CC(=C(C(=C2)O)CC3=CC=CC=C3)O > 66.8 > 326.15180918 > 0 > 24 > 0 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 12 14 8 12 15 8 13 17 8 13 18 8 14 17 8 15 18 8 19 20 8 19 21 8 20 22 8 21 23 8 22 24 8 23 24 8 $$$$