70552019 -OEChem-03292405202D 56 59 0 0 0 0 0 0 0999 V2000 8.9372 5.4575 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -1.1067 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4144 -5.1413 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -5.1067 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9176 -1.0721 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9176 -5.1413 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9603 3.4576 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1232 0.9478 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4144 -1.0721 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9719 2.4577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0886 3.9476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8205 3.9676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1117 1.9477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0770 4.9475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8089 4.9675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2631 0.4378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2746 -0.5621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -2.6067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4260 -2.0720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -3.6067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -2.6067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -3.6067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -2.1067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -4.1067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4260 -4.1414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3321 -2.5859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3321 -3.6275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 -2.0720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 -4.1414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.5859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.6275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1906 1.8776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5812 2.5724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4768 4.0482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8833 3.3626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0393 3.3875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4298 4.0823 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8929 2.5278 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5024 1.8330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8582 5.5276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4677 4.8328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4207 4.8670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0142 5.5526 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6637 0.6440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0443 1.0179 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6538 0.3231 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4934 -1.1422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8839 -0.4474 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8740 -0.7683 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8678 -2.2738 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8678 -3.9396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 -2.2738 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 -3.9396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9478 -5.4575 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3843 -0.7559 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3843 -5.4575 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 2 23 2 0 0 0 0 3 25 1 0 0 0 0 3 54 1 0 0 0 0 4 24 2 0 0 0 0 5 28 1 0 0 0 0 5 55 1 0 0 0 0 6 29 1 0 0 0 0 6 56 1 0 0 0 0 7 10 1 0 0 0 0 7 11 1 0 0 0 0 7 12 1 0 0 0 0 8 13 1 0 0 0 0 8 16 1 0 0 0 0 8 44 1 0 0 0 0 9 17 1 0 0 0 0 9 19 1 0 0 0 0 9 49 1 0 0 0 0 10 13 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 14 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 15 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 17 47 1 0 0 0 0 17 48 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 18 23 1 0 0 0 0 19 26 1 0 0 0 0 20 24 1 0 0 0 0 20 25 2 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 28 2 0 0 0 0 22 24 1 0 0 0 0 22 29 2 0 0 0 0 25 27 1 0 0 0 0 26 27 2 0 0 0 0 26 50 1 0 0 0 0 27 51 1 0 0 0 0 28 30 1 0 0 0 0 29 31 1 0 0 0 0 30 31 2 0 0 0 0 30 52 1 0 0 0 0 31 53 1 0 0 0 0 M END > 70552019 > 1 > 643 > 9 > 5 > 7 > AAADceB7OAAAAAAAAAAAAAAAAAAAAAAAAAA8YMEAAAAAAADBQAAAHgAQCAAADAzhmAYwxoPABgCIAqRSQACCAAAlIgAIiIEObMgKZj7ClJOXcchk8BHY2Uf/+PeOgUABQAAaAACCgAaAADQAAAAAAAAAAA== > 1,4,5-trihydroxy-8-[2-(2-morpholinoethylamino)ethylamino]anthracene-9,10-dione > 1,4,5-trihydroxy-8-[2-[2-(4-morpholinyl)ethylamino]ethylamino]anthracene-9,10-dione > 1,4,5-trihydroxy-8-[2-(2-morpholin-4-ylethylamino)ethylamino]anthracene-9,10-dione > 1,4,5-trihydroxy-8-[2-(2-morpholin-4-ylethylamino)ethylamino]anthracene-9,10-dione > 1-[2-(2-morpholin-4-ylethylamino)ethylamino]-4,5,8-tris(oxidanyl)anthracene-9,10-dione > 1,4,5-trihydroxy-8-[2-(2-morpholinoethylamino)ethylamino]-9,10-anthraquinone > InChI=1S/C22H25N3O6/c26-14-2-1-13(24-6-5-23-7-8-25-9-11-31-12-10-25)17-18(14)22(30)20-16(28)4-3-15(27)19(20)21(17)29/h1-4,23-24,26-28H,5-12H2 > YVPABQXKKKEWKB-UHFFFAOYSA-N > 2.1 > 427.17433553 > C22H25N3O6 > 427.4 > C1COCCN1CCNCCNC2=C3C(=C(C=C2)O)C(=O)C4=C(C=CC(=C4C3=O)O)O > C1COCCN1CCNCCNC2=C3C(=C(C=C2)O)C(=O)C4=C(C=CC(=C4C3=O)O)O > 131 > 427.17433553 > 0 > 31 > 0 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 18 19 8 18 20 8 19 26 8 20 25 8 21 22 8 21 28 8 22 29 8 25 27 8 26 27 8 28 30 8 29 31 8 30 31 8 $$$$