201539 -OEChem-05231306322D 68 69 0 1 0 0 0 0 0999 V2000 6.0981 3.6160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5981 2.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0981 1.8840 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5981 4.4820 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.7500 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.5981 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5981 4.4820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0981 3.6160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0981 5.3481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0981 3.6160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0981 3.6160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0981 5.3481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -5.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 5.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 5.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 5.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 -2.6674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 -3.3577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7057 5.0926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0155 4.6941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9441 -3.3326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3426 -2.6423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0781 -4.8326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4766 -4.1423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9904 3.0054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6807 3.4040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 -1.1674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1215 -1.8577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5155 3.4040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2057 3.0054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2057 5.9587 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5155 5.5601 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 -4.1674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3894 -4.8577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 1.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 1.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -0.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -0.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 3.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 3.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2881 3.2869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0981 2.9960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7181 3.6160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0981 4.2360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0981 4.7281 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7181 5.3481 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0981 5.9681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 -5.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -6.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6200 -5.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 5.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 5.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 6.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 2 15 1 0 0 0 0 2 21 1 0 0 0 0 3 6 1 0 0 0 0 3 56 1 0 0 0 0 4 14 2 0 0 0 0 5 9 1 0 0 0 0 5 16 1 0 0 0 0 5 17 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 6 14 1 0 0 0 0 7 19 2 0 0 0 0 7 20 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 13 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 15 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 18 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 24 2 0 0 0 0 12 25 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 27 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 17 26 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 28 1 0 0 0 0 18 48 1 0 0 0 0 18 49 1 0 0 0 0 19 22 1 0 0 0 0 19 50 1 0 0 0 0 20 23 2 0 0 0 0 20 51 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 22 52 1 0 0 0 0 23 53 1 0 0 0 0 24 29 1 0 0 0 0 24 54 1 0 0 0 0 25 30 2 0 0 0 0 25 55 1 0 0 0 0 26 57 1 0 0 0 0 26 58 1 0 0 0 0 26 59 1 0 0 0 0 27 60 1 0 0 0 0 27 61 1 0 0 0 0 27 62 1 0 0 0 0 28 63 1 0 0 0 0 28 64 1 0 0 0 0 28 65 1 0 0 0 0 29 31 2 0 0 0 0 29 66 1 0 0 0 0 30 31 1 0 0 0 0 30 67 1 0 0 0 0 31 68 1 0 0 0 0 M END > 201539 > 1 > 482 > 5 > 1 > 15 > AAADcfB6OAAAAAAAAAAAAAAAAAAAAAAAAAAwYAAAAAAAAAABQAAAHgAACAAADEThmAYyDoMABgCIAiDSCAICCAAgIAAIiAFOCIgPJjKENRqDeCCkwBGbuAeI6PyOoAAAAAAAAABAAAAAAAAAAAAAAAAAAA== > 2-(diethylamino)ethyl 2-(4-hexoxyphenyl)-2-hydroxy-2-phenyl-acetate > 2-(4-hexoxyphenyl)-2-hydroxy-2-phenylacetic acid 2-(diethylamino)ethyl ester > 2-(diethylamino)ethyl 2-(4-hexoxyphenyl)-2-hydroxy-2-phenylacetate > 2-(diethylamino)ethyl 2-(4-hexoxyphenyl)-2-oxidanyl-2-phenyl-ethanoate > 2-(4-hexoxyphenyl)-2-hydroxy-2-phenyl-acetic acid 2-(diethylamino)ethyl ester > InChI=1S/C26H37NO4/c1-4-7-8-12-20-30-24-17-15-23(16-18-24)26(29,22-13-10-9-11-14-22)25(28)31-21-19-27(5-2)6-3/h9-11,13-18,29H,4-8,12,19-21H2,1-3H3 > VTQHDICZORLCQT-UHFFFAOYSA-N > 5.7 > 427.272259 > C26H37NO4 > 427.57628 > CCCCCCOC1=CC=C(C=C1)C(C2=CC=CC=C2)(C(=O)OCCN(CC)CC)O > CCCCCCOC1=CC=C(C=C1)C(C2=CC=CC=C2)(C(=O)OCCN(CC)CC)O > 59 > 427.272259 > 0 > 31 > 0 > 1 > 0 > 0 > 0 > 1 > 1 > 1 5 255 > 12 24 8 12 25 8 19 22 8 20 23 8 21 22 8 21 23 8 24 29 8 25 30 8 29 31 8 6 3 3 30 31 8 7 19 8 7 20 8 $$$$