26860187 -OEChem-05072423142D 57 60 0 0 0 0 0 0 0999 V2000 4.6783 1.2377 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.7619 -0.4330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7619 -2.1651 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7619 3.0311 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 5.2619 2.1651 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.7619 1.2990 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.7619 -0.4330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -0.3717 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2619 0.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7619 -0.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7619 -0.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 0.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7619 -0.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7619 1.2990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2619 -1.2990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2619 -1.2990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2619 0.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2619 0.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2619 0.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2619 0.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7619 -0.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7619 1.2990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2619 0.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7619 -0.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7619 1.2990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2619 2.1651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2619 -3.0311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2619 0.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7619 1.2990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4519 -0.9699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2368 0.9005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2368 1.6976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9519 -1.8360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9519 0.9699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3695 1.0436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6793 0.6451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5719 0.9699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.0530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.1870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4519 -0.9699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4519 1.8360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 1.2430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.3770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0719 -0.9699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0719 1.8360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7249 -2.7211 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9519 -3.5680 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7988 -3.3411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7619 0.6790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3819 1.2990 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7619 1.9190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 17 1 0 0 0 0 2 13 1 0 0 0 0 2 20 1 0 0 0 0 3 16 1 0 0 0 0 3 33 1 0 0 0 0 4 32 1 0 0 0 0 5 32 2 0 0 0 0 6 34 1 0 0 0 0 6 35 1 0 0 0 0 7 34 2 0 0 0 0 8 12 2 0 0 0 0 8 18 1 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 10 19 1 0 0 0 0 11 36 1 0 0 0 0 13 16 2 0 0 0 0 13 21 1 0 0 0 0 14 32 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 17 18 1 0 0 0 0 17 23 2 0 0 0 0 18 24 2 0 0 0 0 19 21 2 0 0 0 0 19 40 1 0 0 0 0 20 22 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 43 1 0 0 0 0 22 25 2 0 0 0 0 22 26 1 0 0 0 0 23 28 1 0 0 0 0 23 44 1 0 0 0 0 24 29 1 0 0 0 0 24 45 1 0 0 0 0 25 30 1 0 0 0 0 25 46 1 0 0 0 0 26 31 2 0 0 0 0 26 47 1 0 0 0 0 27 30 2 0 0 0 0 27 31 1 0 0 0 0 27 34 1 0 0 0 0 28 29 2 0 0 0 0 28 48 1 0 0 0 0 29 49 1 0 0 0 0 30 50 1 0 0 0 0 31 51 1 0 0 0 0 33 52 1 0 0 0 0 33 53 1 0 0 0 0 33 54 1 0 0 0 0 35 55 1 0 0 0 0 35 56 1 0 0 0 0 35 57 1 0 0 0 0 M CHG 1 4 -1 M END > 26860187 > 1 > 746 > 8 > 0 > 9 > AAADceB6OABAAAAAAAAAAAAAAAAAAWAAAAAwYMAAAAAAAFgB9AAAHgQAAAAADAyh3gIyz7IIFAisAyTyTACD+KBlKjhImD027NgNJrLktZuGOSrkwBHq6Ye8yDCOYAABAAAAQQDAAAIAAACCAAAAAAAAAA== > (E)-3-(1,3-benzothiazol-2-yl)-4-[3-methoxy-4-[(4-methoxycarbonylphenyl)methoxy]phenyl]but-3-enoate > (E)-3-(1,3-benzothiazol-2-yl)-4-[3-methoxy-4-[(4-methoxycarbonylphenyl)methoxy]phenyl]-3-butenoate > (E)-3-(1,3-benzothiazol-2-yl)-4-[3-methoxy-4-[(4-methoxycarbonylphenyl)methoxy]phenyl]but-3-enoate > (E)-3-(1,3-benzothiazol-2-yl)-4-[3-methoxy-4-[(4-methoxycarbonylphenyl)methoxy]phenyl]but-3-enoate > (E)-3-(1,3-benzothiazol-2-yl)-4-[3-methoxy-4-[(4-methoxycarbonylphenyl)methoxy]phenyl]but-3-enoate > (E)-3-(1,3-benzothiazol-2-yl)-4-[4-(4-carbomethoxybenzyl)oxy-3-methoxy-phenyl]but-3-enoate > InChI=1S/C27H23NO6S/c1-32-23-14-18(9-12-22(23)34-16-17-7-10-19(11-8-17)27(31)33-2)13-20(15-25(29)30)26-28-21-5-3-4-6-24(21)35-26/h3-14H,15-16H2,1-2H3,(H,29,30)/p-1/b20-13+ > UICRYFWFKPWZNZ-DEDYPNTBSA-M > 6.3 > 488.11678360 > C27H22NO6S- > 488.5 > COC1=C(C=CC(=C1)C=C(CC(=O)[O-])C2=NC3=CC=CC=C3S2)OCC4=CC=C(C=C4)C(=O)OC > COC1=C(C=CC(=C1)/C=C(\CC(=O)[O-])/C2=NC3=CC=CC=C3S2)OCC4=CC=C(C=C4)C(=O)OC > 126 > 488.11678360 > -1 > 35 > 0 > 0 > 1 > 0 > 0 > 1 > -1 > 1 5 255 > 1 12 8 1 17 8 10 15 8 10 19 8 13 16 8 13 21 8 15 16 8 17 18 8 17 23 8 18 24 8 19 21 8 22 25 8 22 26 8 23 28 8 24 29 8 25 30 8 26 31 8 27 30 8 27 31 8 28 29 8 8 12 8 8 18 8 $$$$