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0 0 0 0 0 0 0 5.5321 -3.2032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8205 4.3711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4260 -1.6685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5882 5.4469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4260 -3.7379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9120 6.8923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -2.2032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7662 7.4122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -3.2032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9351 5.8926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -1.7032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6436 6.9323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -3.7032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9719 2.8612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2746 -0.1586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1117 2.3512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2631 0.8413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7305 3.8643 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3321 -2.1824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6203 4.4058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3321 -3.2240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3192 5.5070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2746 -5.2478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9905 7.3780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 -1.6685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7582 8.4538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 -3.7379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1673 6.0368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2631 -6.2477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9584 8.4191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.1824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8482 8.9606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.2240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8984 6.0968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1117 -7.7576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7812 5.6272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9719 -8.2676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1906 2.2811 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5812 2.9759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4934 -0.7387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8839 -0.0439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4198 4.1649 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8740 -0.3648 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8929 2.9313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5024 2.2365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0443 1.4214 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6538 0.7266 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7424 3.2444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8678 -1.8703 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1654 4.1104 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8678 -3.5361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6637 1.0475 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4148 6.5963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8740 -5.0416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9374 5.0185 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7339 5.0462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8839 -5.3625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4934 -4.6676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5492 6.5252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7526 6.4976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6538 -6.1330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0443 -6.8278 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4133 8.7145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 -1.8703 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8362 9.5805 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 -3.5361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0717 4.9475 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6637 -6.4539 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2802 6.5853 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4836 6.5577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5024 -7.6429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8929 -8.3377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5950 7.1394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3843 -0.3524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6112 9.5837 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3843 -5.0540 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3994 5.1387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.1960 5.1663 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5812 -8.3823 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1906 -7.6875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1767 5.8657 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4936 -9.5837 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 30 2 0 0 0 0 2 31 2 0 0 0 0 3 32 2 0 0 0 0 4 33 2 0 0 0 0 5 44 1 0 0 0 0 5 93 1 0 0 0 0 6 45 1 0 0 0 0 6 94 1 0 0 0 0 7 46 1 0 0 0 0 7 95 1 0 0 0 0 8 47 1 0 0 0 0 8 96 1 0 0 0 0 9 56 1 0 0 0 0 9101 1 0 0 0 0 10 57 1 0 0 0 0 10102 1 0 0 0 0 11 22 1 0 0 0 0 11 34 1 0 0 0 0 11 62 1 0 0 0 0 12 23 1 0 0 0 0 12 35 1 0 0 0 0 12 63 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 13 72 1 0 0 0 0 14 24 1 0 0 0 0 14 42 1 0 0 0 0 14 73 1 0 0 0 0 15 25 1 0 0 0 0 15 43 1 0 0 0 0 15 74 1 0 0 0 0 16 48 1 0 0 0 0 16 54 1 0 0 0 0 16 87 1 0 0 0 0 17 49 1 0 0 0 0 17 55 1 0 0 0 0 17 88 1 0 0 0 0 18 20 1 0 0 0 0 18 22 2 0 0 0 0 18 30 1 0 0 0 0 19 21 1 0 0 0 0 19 23 2 0 0 0 0 19 31 1 0 0 0 0 20 24 2 0 0 0 0 20 32 1 0 0 0 0 21 25 2 0 0 0 0 21 33 1 0 0 0 0 22 38 1 0 0 0 0 23 39 1 0 0 0 0 24 40 1 0 0 0 0 25 41 1 0 0 0 0 26 28 1 0 0 0 0 26 30 1 0 0 0 0 26 44 2 0 0 0 0 27 29 1 0 0 0 0 27 31 1 0 0 0 0 27 45 2 0 0 0 0 28 32 1 0 0 0 0 28 46 2 0 0 0 0 29 33 1 0 0 0 0 29 47 2 0 0 0 0 34 36 1 0 0 0 0 34 58 1 0 0 0 0 34 59 1 0 0 0 0 35 37 1 0 0 0 0 35 60 1 0 0 0 0 35 61 1 0 0 0 0 36 64 1 0 0 0 0 36 65 1 0 0 0 0 37 66 1 0 0 0 0 37 67 1 0 0 0 0 38 40 2 0 0 0 0 38 68 1 0 0 0 0 39 41 2 0 0 0 0 39 69 1 0 0 0 0 40 70 1 0 0 0 0 41 71 1 0 0 0 0 42 48 1 0 0 0 0 42 75 1 0 0 0 0 42 76 1 0 0 0 0 43 49 1 0 0 0 0 43 77 1 0 0 0 0 43 78 1 0 0 0 0 44 50 1 0 0 0 0 45 51 1 0 0 0 0 46 52 1 0 0 0 0 47 53 1 0 0 0 0 48 79 1 0 0 0 0 48 80 1 0 0 0 0 49 81 1 0 0 0 0 49 82 1 0 0 0 0 50 52 2 0 0 0 0 50 83 1 0 0 0 0 51 53 2 0 0 0 0 51 84 1 0 0 0 0 52 85 1 0 0 0 0 53 86 1 0 0 0 0 54 56 1 0 0 0 0 54 89 1 0 0 0 0 54 90 1 0 0 0 0 55 57 1 0 0 0 0 55 91 1 0 0 0 0 55 92 1 0 0 0 0 56 97 1 0 0 0 0 56 98 1 0 0 0 0 57 99 1 0 0 0 0 57100 1 0 0 0 0 M END > 70500905 > 1 > 1270 > 17 > 13 > 20 > AAADcfB/vAAAAAAAAAAAAAAAAAAAAAAAAAAwYMGDAAAAAADBVAAAHgAQCAAADAzhmAYwxoLAAgCIAqRSQACCAAAlIgAIiIEObMgKdj7ClJOUcchk8BHY2Uff2POOgQCBQAAaAACCAQaAADQAAAAAAAAAAA== > 1-[2-[2-[[5,8-dihydroxy-4-[2-(2-hydroxyethylamino)ethylamino]-9,10-dioxo-1-anthryl]amino]ethylamino]ethylamino]-5,8-dihydroxy-4-[2-(2-hydroxyethylamino)ethylamino]anthracene-9,10-dione > 1-[2-[2-[[5,8-dihydroxy-4-[2-(2-hydroxyethylamino)ethylamino]-9,10-dioxo-1-anthracenyl]amino]ethylamino]ethylamino]-5,8-dihydroxy-4-[2-(2-hydroxyethylamino)ethylamino]anthracene-9,10-dione > 1-[2-[2-[[5,8-dihydroxy-4-[2-(2-hydroxyethylamino)ethylamino]-9,10-dioxoanthracen-1-yl]amino]ethylamino]ethylamino]-5,8-dihydroxy-4-[2-(2-hydroxyethylamino)ethylamino]anthracene-9,10-dione > 1-[2-[2-[[5,8-dihydroxy-4-[2-(2-hydroxyethylamino)ethylamino]-9,10-dioxoanthracen-1-yl]amino]ethylamino]ethylamino]-5,8-dihydroxy-4-[2-(2-hydroxyethylamino)ethylamino]anthracene-9,10-dione > 1-[2-(2-hydroxyethylamino)ethylamino]-4-[2-[2-[[4-[2-(2-hydroxyethylamino)ethylamino]-5,8-bis(oxidanyl)-9,10-bis(oxidanylidene)anthracen-1-yl]amino]ethylamino]ethylamino]-5,8-bis(oxidanyl)anthracene-9,10-dione > 1-[2-[2-[[5,8-dihydroxy-4-[2-(2-hydroxyethylamino)ethylamino]-9,10-diketo-1-anthryl]amino]ethylamino]ethylamino]-5,8-dihydroxy-4-[2-(2-hydroxyethylamino)ethylamino]-9,10-anthraquinone > InChI=1S/C40H45N7O10/c48-19-17-42-11-15-46-23-3-1-21(29-31(23)39(56)35-27(52)7-5-25(50)33(35)37(29)54)44-13-9-41-10-14-45-22-2-4-24(47-16-12-43-18-20-49)32-30(22)38(55)34-26(51)6-8-28(53)36(34)40(32)57/h1-8,41-53H,9-20H2 > UCXZDQXUZOFYMV-UHFFFAOYSA-N > 3.6 > 783.32279066 > C40H45N7O10 > 783.8 > C1=CC(=C2C(=C1NCCNCCNC3=C4C(=C(C=C3)NCCNCCO)C(=O)C5=C(C=CC(=C5C4=O)O)O)C(=O)C6=C(C=CC(=C6C2=O)O)O)NCCNCCO > C1=CC(=C2C(=C1NCCNCCNC3=C4C(=C(C=C3)NCCNCCO)C(=O)C5=C(C=CC(=C5C4=O)O)O)C(=O)C6=C(C=CC(=C6C2=O)O)O)NCCNCCO > 274 > 783.32279066 > 0 > 57 > 0 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 18 20 8 18 22 8 19 21 8 19 23 8 20 24 8 21 25 8 22 38 8 23 39 8 24 40 8 25 41 8 26 28 8 26 44 8 27 29 8 27 45 8 28 46 8 29 47 8 38 40 8 39 41 8 44 50 8 45 51 8 46 52 8 47 53 8 50 52 8 51 53 8 $$$$