11395057 -OEChem-03282409502D 54 56 0 1 0 0 0 0 0999 V2000 7.2622 0.2723 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2622 -1.7277 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5138 -2.7623 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5923 -0.2277 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8602 2.7723 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5923 1.7723 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1282 -0.2277 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.1282 -1.2277 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.9942 0.2723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3961 -0.2277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3961 -1.2277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9942 -1.7277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9942 1.2723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8602 -0.2277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5022 -1.7624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5022 0.3069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5961 -0.2069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5961 -1.2485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7263 0.2723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8602 1.7723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7263 1.2723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.2964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8641 -0.2002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6536 -3.2723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5923 -1.2277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9942 3.2723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5923 2.7723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.3031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1282 0.3923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1282 -1.8477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6842 -2.2646 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5312 -2.0377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3042 -1.1908 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4573 1.5823 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8602 -0.8477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5094 0.9269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0604 -1.5606 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1324 0.7698 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3353 0.7729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8617 -0.8202 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3374 -2.7390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1203 -3.5885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9698 -3.8056 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9723 -1.2277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5923 -1.8477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2123 -1.2277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3042 3.8092 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4573 3.5823 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6842 2.7354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2123 2.7723 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5923 3.3923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9723 2.7723 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0024 0.9231 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4619 -0.0048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 10 1 0 0 0 0 2 8 1 0 0 0 0 2 11 1 0 0 0 0 3 15 1 0 0 0 0 3 24 1 0 0 0 0 4 19 1 0 0 0 0 4 25 1 0 0 0 0 5 20 1 0 0 0 0 5 26 1 0 0 0 0 6 21 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 6 0 0 0 7 29 1 0 0 0 0 8 12 1 1 0 0 0 8 30 1 0 0 0 0 9 13 2 0 0 0 0 9 14 1 0 0 0 0 10 11 2 0 0 0 0 10 16 1 0 0 0 0 11 15 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 20 1 0 0 0 0 13 34 1 0 0 0 0 14 19 2 0 0 0 0 14 35 1 0 0 0 0 15 18 2 0 0 0 0 16 17 2 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 37 1 0 0 0 0 19 21 1 0 0 0 0 20 21 2 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 23 28 2 0 0 0 0 23 40 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 M END > 11395057 > 1 > 485 > 6 > 0 > 7 > AAADceB4OAAAAAAAAAAAAAAAAAAAAAAAAAA0YIAAAAAAAACRQAAAGgAAAAAADBSgmAIyBoAABACAAiBCAAACCAAgIAAIiAAGiIgNJyKEMRqCOCKlwBUKqAfA4LwOIAABCAAAQABAAAIQAACAAAAAAAAAAA== > (2R,3R)-7-allyl-5-methoxy-3-methyl-2-(3,4,5-trimethoxyphenyl)-2,3-dihydro-1,4-benzodioxine > (2R,3R)-5-methoxy-3-methyl-7-prop-2-enyl-2-(3,4,5-trimethoxyphenyl)-2,3-dihydro-1,4-benzodioxin > (2R,3R)-5-methoxy-3-methyl-7-prop-2-enyl-2-(3,4,5-trimethoxyphenyl)-2,3-dihydro-1,4-benzodioxine > (2R,3R)-5-methoxy-3-methyl-7-prop-2-enyl-2-(3,4,5-trimethoxyphenyl)-2,3-dihydro-1,4-benzodioxine > (2R,3R)-5-methoxy-3-methyl-7-prop-2-enyl-2-(3,4,5-trimethoxyphenyl)-2,3-dihydro-1,4-benzodioxine > (2R,3R)-7-allyl-5-methoxy-3-methyl-2-(3,4,5-trimethoxyphenyl)-2,3-dihydro-1,4-benzodioxin > InChI=1S/C22H26O6/c1-7-8-14-9-16(23-3)22-19(10-14)28-20(13(2)27-22)15-11-17(24-4)21(26-6)18(12-15)25-5/h7,9-13,20H,1,8H2,2-6H3/t13-,20+/m1/s1 > BVNKWNRETUIZFZ-XCLFUZPHSA-N > 4.6 > 386.17293854 > C22H26O6 > 386.4 > CC1C(OC2=C(O1)C(=CC(=C2)CC=C)OC)C3=CC(=C(C(=C3)OC)OC)OC > C[C@@H]1[C@H](OC2=C(O1)C(=CC(=C2)CC=C)OC)C3=CC(=C(C(=C3)OC)OC)OC > 55.4 > 386.17293854 > 0 > 28 > 2 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 10 11 8 10 16 8 11 15 8 13 20 8 14 19 8 15 18 8 16 17 8 17 18 8 19 21 8 20 21 8 7 9 6 8 12 5 9 13 8 9 14 8 $$$$