155435 -OEChem-04252401032D 65 69 0 1 0 0 0 0 0999 V2000 10.3984 -0.5600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0682 0.9400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5381 0.9158 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3984 4.4400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2644 -3.0600 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3984 -3.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1304 -3.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3984 -4.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1304 -4.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2644 -5.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2644 -2.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3984 -1.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9343 1.4400 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9343 2.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0682 2.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8003 0.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2022 2.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2022 1.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8003 2.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5323 -0.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8003 -0.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6663 1.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0682 3.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6663 -0.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5323 0.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3083 2.9747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3083 0.9053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6663 2.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8003 3.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4022 2.4608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4022 1.4192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5323 2.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6663 4.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5323 3.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1863 -2.9774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7878 -3.6677 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7410 -3.6677 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3425 -2.9774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7878 -4.4523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1863 -5.1426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3425 -5.1426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7410 -4.4523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8659 -5.5350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6629 -5.5350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8750 -2.1677 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4765 -1.4774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7878 -1.4523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1863 -2.1426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4712 1.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2634 -0.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6663 2.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6882 3.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0682 4.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4482 3.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6663 -1.1800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0693 1.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3154 3.5946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3154 0.2854 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6663 1.8200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2634 4.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8665 2.7729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0693 2.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6663 5.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.2238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3984 5.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 20 1 0 0 0 0 2 13 1 0 0 0 0 2 18 1 0 0 0 0 3 31 1 0 0 0 0 3 64 1 0 0 0 0 4 34 1 0 0 0 0 4 65 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 6 8 1 0 0 0 0 6 35 1 0 0 0 0 6 36 1 0 0 0 0 7 9 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 8 10 1 0 0 0 0 8 39 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 41 1 0 0 0 0 9 42 1 0 0 0 0 10 43 1 0 0 0 0 10 44 1 0 0 0 0 11 12 1 0 0 0 0 11 45 1 0 0 0 0 11 46 1 0 0 0 0 12 47 1 0 0 0 0 12 48 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 6 0 0 0 13 49 1 0 0 0 0 14 15 2 0 0 0 0 14 19 1 0 0 0 0 15 17 1 0 0 0 0 15 23 1 0 0 0 0 16 21 2 0 0 0 0 16 22 1 0 0 0 0 17 18 2 0 0 0 0 17 26 1 0 0 0 0 18 27 1 0 0 0 0 19 28 2 0 0 0 0 19 29 1 0 0 0 0 20 24 2 0 0 0 0 20 25 1 0 0 0 0 21 24 1 0 0 0 0 21 50 1 0 0 0 0 22 25 2 0 0 0 0 22 51 1 0 0 0 0 23 52 1 0 0 0 0 23 53 1 0 0 0 0 23 54 1 0 0 0 0 24 55 1 0 0 0 0 25 56 1 0 0 0 0 26 30 2 0 0 0 0 26 57 1 0 0 0 0 27 31 2 0 0 0 0 27 58 1 0 0 0 0 28 32 1 0 0 0 0 28 59 1 0 0 0 0 29 33 2 0 0 0 0 29 60 1 0 0 0 0 30 31 1 0 0 0 0 30 61 1 0 0 0 0 32 34 2 0 0 0 0 32 62 1 0 0 0 0 33 34 1 0 0 0 0 33 63 1 0 0 0 0 M END > 155435 > 1 > 674 > 5 > 2 > 6 > AAADceB6OAAAAAAAAAAAAAAAAAAAAAAAAAA8YMECAAAAAACBUAAAHgAACAAADBThmAYyBoMABgCAAiBCAAACCAAgIAAIiAAOCIgOJyKGsRqHeCClwBWYuAeQ4OwOIAAACAAIAABAAAAQABAAAAAAAAAAAA== > (2S)-3-(4-hydroxyphenyl)-4-methyl-2-[4-[2-(1-piperidyl)ethoxy]phenyl]-2H-chromen-7-ol > (2S)-3-(4-hydroxyphenyl)-4-methyl-2-[4-[2-(1-piperidinyl)ethoxy]phenyl]-2H-1-benzopyran-7-ol > (2S)-3-(4-hydroxyphenyl)-4-methyl-2-[4-(2-piperidin-1-ylethoxy)phenyl]-2H-chromen-7-ol > (2S)-3-(4-hydroxyphenyl)-4-methyl-2-[4-(2-piperidin-1-ylethoxy)phenyl]-2H-chromen-7-ol > (2S)-3-(4-hydroxyphenyl)-4-methyl-2-[4-(2-piperidin-1-ylethoxy)phenyl]-2H-chromen-7-ol > (2S)-3-(4-hydroxyphenyl)-4-methyl-2-[4-(2-piperidinoethoxy)phenyl]-2H-chromen-7-ol > InChI=1S/C29H31NO4/c1-20-26-14-11-24(32)19-27(26)34-29(28(20)21-5-9-23(31)10-6-21)22-7-12-25(13-8-22)33-18-17-30-15-3-2-4-16-30/h5-14,19,29,31-32H,2-4,15-18H2,1H3/t29-/m0/s1 > DUYNJNWVGIWJRI-LJAQVGFWSA-N > 5.2 > 457.22530847 > C29H31NO4 > 457.6 > CC1=C(C(OC2=C1C=CC(=C2)O)C3=CC=C(C=C3)OCCN4CCCCC4)C5=CC=C(C=C5)O > CC1=C([C@@H](OC2=C1C=CC(=C2)O)C3=CC=C(C=C3)OCCN4CCCCC4)C5=CC=C(C=C5)O > 62.2 > 457.22530847 > 0 > 34 > 1 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 13 16 6 16 21 8 16 22 8 17 18 8 17 26 8 18 27 8 19 28 8 19 29 8 20 24 8 20 25 8 21 24 8 22 25 8 26 30 8 27 31 8 28 32 8 29 33 8 30 31 8 32 34 8 33 34 8 $$$$