6604373 -OEChem-04192404442D 67 71 0 1 0 0 0 0 0999 V2000 6.0010 -0.9435 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.9435 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2925 -3.8691 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -2.9435 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8878 0.5637 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3748 -1.3961 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8058 -4.7273 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7143 2.1049 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2616 0.1112 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5769 3.7276 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -3.9435 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -1.4435 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7791 -2.9954 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.8711 -2.4851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6710 -2.4574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7711 -0.9261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6429 -1.4161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.4435 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.1350 -2.4435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.9435 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4030 -2.4435 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4030 -1.4435 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7596 0.0738 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2924 -3.8537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5031 -0.9061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6198 0.5838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4915 0.0938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -0.9435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2923 -3.8382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5917 1.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3956 0.6112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4835 2.1631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3916 1.6528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4543 3.2477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3333 2.1916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3833 3.8082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3291 3.2766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5538 4.7273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3307 -1.7545 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2598 -2.3814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6643 -3.0696 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8957 -3.0352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2788 -2.3348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6720 -1.7535 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3471 -3.0261 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7456 -2.3358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8059 -3.2535 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -3.0635 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -0.8235 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6726 -3.8786 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8469 -0.4065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.6335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2269 -1.4804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.2535 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8059 -4.2535 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3018 -4.4582 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9122 -3.8287 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2827 -3.2183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.6335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8807 1.1837 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3820 -2.0160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8702 1.8816 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3737 4.4282 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8636 3.5908 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1736 4.7416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5394 5.3471 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9340 4.7130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12 1 1 1 0 0 0 18 1 1 6 0 0 0 2 18 1 0 0 0 0 2 22 1 0 0 0 0 13 3 1 1 0 0 0 3 50 1 0 0 0 0 21 4 1 6 0 0 0 4 59 1 0 0 0 0 5 23 1 0 0 0 0 5 60 1 0 0 0 0 6 25 1 0 0 0 0 6 61 1 0 0 0 0 7 24 2 0 0 0 0 8 30 2 0 0 0 0 9 31 2 0 0 0 0 10 34 1 0 0 0 0 10 38 1 0 0 0 0 20 11 1 6 0 0 0 11 54 1 0 0 0 0 11 55 1 0 0 0 0 12 14 1 0 0 0 0 12 16 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 24 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 17 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 2 0 0 0 0 16 23 1 0 0 0 0 17 25 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 22 28 1 6 0 0 0 22 49 1 0 0 0 0 23 26 2 0 0 0 0 24 29 1 0 0 0 0 25 27 2 0 0 0 0 26 27 1 0 0 0 0 26 30 1 0 0 0 0 27 31 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 29 56 1 0 0 0 0 29 57 1 0 0 0 0 29 58 1 0 0 0 0 30 32 1 0 0 0 0 31 33 1 0 0 0 0 32 33 2 0 0 0 0 32 34 1 0 0 0 0 33 35 1 0 0 0 0 34 36 2 0 0 0 0 35 37 2 0 0 0 0 35 62 1 0 0 0 0 36 37 1 0 0 0 0 36 63 1 0 0 0 0 37 64 1 0 0 0 0 38 65 1 0 0 0 0 38 66 1 0 0 0 0 38 67 1 0 0 0 0 M END > 6604373 > 1 > 960 > 11 > 5 > 4 > AAADceB6PAAAAAAAAAAAAAAAAAAAAAAAAAA0YMGCAAAAAADBQAAAHgAQCAAADHzxmAcyDoBABgCIAqBSAAICCAAkIAAIiIFGCMgfNzaGtRqicWAn8BEPuYfL7PzOwQADAAAYAADCAAYQADAAAAAAAAAAAA== > (7R,9R)-9-acetyl-7-[(2S,4S,5S,6S)-4-amino-5-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-6,9,11-trihydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione > (7R,9R)-9-acetyl-7-[[(2S,4S,5S,6S)-4-amino-5-hydroxy-6-methyl-2-oxanyl]oxy]-6,9,11-trihydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione > (7R,9R)-9-acetyl-7-[(2S,4S,5S,6S)-4-amino-5-hydroxy-6-methyloxan-2-yl]oxy-6,9,11-trihydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione > (7R,9R)-9-acetyl-7-[(2S,4S,5S,6S)-4-amino-5-hydroxy-6-methyloxan-2-yl]oxy-6,9,11-trihydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione > (7R,9R)-7-[(2S,4S,5S,6S)-4-azanyl-6-methyl-5-oxidanyl-oxan-2-yl]oxy-9-ethanoyl-4-methoxy-6,9,11-tris(oxidanyl)-8,10-dihydro-7H-tetracene-5,12-dione > (7R,9R)-9-acetyl-7-[(2S,4S,5S,6S)-4-amino-5-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-6,9,11-trihydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-quinone > InChI=1S/C27H29NO10/c1-10-22(30)14(28)7-17(37-10)38-16-9-27(35,11(2)29)8-13-19(16)26(34)21-20(24(13)32)23(31)12-5-4-6-15(36-3)18(12)25(21)33/h4-6,10,14,16-17,22,30,32,34-35H,7-9,28H2,1-3H3/t10-,14-,16+,17+,22+,27+/m0/s1 > STQGQHZAVUOBTE-GVTUGOAOSA-N > 1.8 > 527.17914612 > C27H29NO10 > 527.5 > CC1C(C(CC(O1)OC2CC(CC3=C2C(=C4C(=C3O)C(=O)C5=C(C4=O)C(=CC=C5)OC)O)(C(=O)C)O)N)O > C[C@H]1[C@H]([C@H](C[C@H](O1)O[C@@H]2C[C@](CC3=C2C(=C4C(=C3O)C(=O)C5=C(C4=O)C(=CC=C5)OC)O)(C(=O)C)O)N)O > 186 > 527.17914612 > 0 > 38 > 6 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 12 1 5 18 1 6 20 11 6 16 17 8 16 23 8 17 25 8 22 28 6 23 26 8 25 27 8 26 27 8 13 3 5 32 33 8 32 34 8 33 35 8 34 36 8 35 37 8 36 37 8 21 4 6 $$$$