5483905 -OEChem-05211305182D 72 76 0 1 0 0 0 0 0999 V2000 11.5884 0.8990 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7321 -1.6044 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3205 0.9056 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3243 -0.0944 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8602 -0.1077 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3320 -2.0944 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5807 2.8989 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3089 3.9056 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.0448 2.9123 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4718 -3.5977 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.1319 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0785 -3.1665 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -3.1319 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.1319 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.3681 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5923 -0.1010 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.4602 -0.5977 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.4641 -1.5977 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.4525 1.4023 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.4487 2.4023 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.7282 -0.6044 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.6000 -2.1010 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.3128 2.9056 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 14.1807 2.4090 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 14.1846 1.4090 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.6039 -3.1010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0525 0.9123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 -0.6111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0901 -0.0972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 -1.6527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.6319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0901 -2.1665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -1.6319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -2.1319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.6319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.6319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.1319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.8681 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.6319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.3681 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.1319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.8681 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1280 0.2110 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9984 -0.9056 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4665 -2.2177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4549 0.7823 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1925 -0.9164 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9129 2.0902 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0643 -2.4131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8485 3.2177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1783 3.0290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1870 0.7890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9929 -2.9957 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3940 -3.6844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7446 0.3742 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5906 0.6044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3604 1.4504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8625 -0.4023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8678 -1.7823 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5783 3.5189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8446 4.2177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5829 2.6044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4742 -4.2177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0829 0.5228 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5319 -1.9648 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6118 -3.4826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 1.1781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.2519 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.7519 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.9881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -0.4419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.9881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16 1 1 6 0 0 0 19 1 1 1 0 0 0 2 21 1 0 0 0 0 2 22 1 0 0 0 0 3 19 1 0 0 0 0 3 25 1 0 0 0 0 17 4 1 1 0 0 0 4 58 1 0 0 0 0 21 5 1 1 0 0 0 5 28 1 0 0 0 0 18 6 1 6 0 0 0 6 59 1 0 0 0 0 20 7 1 6 0 0 0 7 60 1 0 0 0 0 23 8 1 6 0 0 0 8 61 1 0 0 0 0 24 9 1 1 0 0 0 9 62 1 0 0 0 0 10 26 1 0 0 0 0 10 63 1 0 0 0 0 11 31 1 0 0 0 0 11 35 1 0 0 0 0 12 32 1 0 0 0 0 12 66 1 0 0 0 0 13 34 2 0 0 0 0 14 36 1 0 0 0 0 14 69 1 0 0 0 0 15 42 1 0 0 0 0 15 72 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 18 22 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 20 23 1 0 0 0 0 20 48 1 0 0 0 0 21 47 1 0 0 0 0 22 26 1 1 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 24 51 1 0 0 0 0 25 27 1 6 0 0 0 25 52 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 27 57 1 0 0 0 0 28 29 1 0 0 0 0 28 30 2 0 0 0 0 29 31 2 0 0 0 0 29 64 1 0 0 0 0 30 32 1 0 0 0 0 30 65 1 0 0 0 0 31 33 1 0 0 0 0 32 33 2 0 0 0 0 33 34 1 0 0 0 0 34 36 1 0 0 0 0 35 36 2 0 0 0 0 35 37 1 0 0 0 0 37 38 2 0 0 0 0 37 39 1 0 0 0 0 38 40 1 0 0 0 0 38 67 1 0 0 0 0 39 41 2 0 0 0 0 39 68 1 0 0 0 0 40 42 2 0 0 0 0 40 70 1 0 0 0 0 41 42 1 0 0 0 0 41 71 1 0 0 0 0 M END > 5483905 > 1 > 985 > 15 > 9 > 6 > AAADceB4PAAAAAAAAAAAAAAAAAAAAAAAAAA0aIECAAAAAACBQAAAGgAACAAADBSwmAMyDoAABgCIAqBSAAICCAAkIAAIiAFGCMgdNzaGNRqieWCl4BUPuQfI7KzOIAAACAAIAABAAAAQABAAAAAAAAAAAA== > 7-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxy-3,5-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one > 7-[[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-2-oxanyl]oxy]-2-oxanyl]oxy]-3,5-dihydroxy-2-(4-hydroxyphenyl)-1-benzopyran-4-one > 7-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-3,5-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one > 7-[(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-6-methyl-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-4,5-bis(oxidanyl)oxan-2-yl]oxy-2-(4-hydroxyphenyl)-3,5-bis(oxidanyl)chromen-4-one > 7-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-methylol-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxy-3,5-dihydroxy-2-(4-hydroxyphenyl)chromone > InChI=1S/C27H30O15/c1-9-17(31)20(34)23(37)26(38-9)42-25-21(35)18(32)15(8-28)41-27(25)39-12-6-13(30)16-14(7-12)40-24(22(36)19(16)33)10-2-4-11(29)5-3-10/h2-7,9,15,17-18,20-21,23,25-32,34-37H,8H2,1H3/t9-,15+,17-,18+,20+,21-,23+,25+,26-,27+/m0/s1 > ZEJXENDZTYVXDP-CSJHBIPPSA-N > -0.4 > 594.15847 > C27H30O15 > 594.5181 > CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C4C(=C3)OC(=C(C4=O)O)C5=CC=C(C=C5)O)O)CO)O)O)O)O)O > C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@@H]([C@H](O[C@H]2OC3=CC(=C4C(=C3)OC(=C(C4=O)O)C5=CC=C(C=C5)O)O)CO)O)O)O)O)O > 245 > 594.15847 > 0 > 42 > 10 > 0 > 0 > 0 > 0 > 1 > 53 > 1 5 255 > 16 1 6 19 1 5 11 31 8 11 35 8 22 26 5 25 27 6 28 29 8 28 30 8 29 31 8 30 32 8 31 33 8 32 33 8 33 34 8 34 36 8 35 36 8 37 38 8 37 39 8 38 40 8 39 41 8 17 4 5 40 42 8 41 42 8 21 5 5 18 6 6 20 7 6 23 8 6 24 9 5 $$$$