HMDB0033949 RDKit 3D beta-Sitosterol 3-O-beta-D-galactopyranoside 101105 0 0 0 0 0 0 0 0999 V2000 -8.8415 0.7407 1.8814 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1184 0.2431 0.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8420 -0.4818 0.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7913 0.3177 1.6476 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3742 1.5643 0.8858 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7622 1.2495 -0.4627 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4423 2.5914 -1.0842 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6699 0.2707 -0.4781 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2768 0.0785 -1.9563 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9071 0.6603 -2.1321 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5268 1.2705 -0.8024 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0795 1.3182 -0.5332 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5930 1.7266 -1.8479 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0485 1.7554 -1.7034 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6413 0.7023 -1.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0966 0.7842 -0.9837 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6523 -0.2163 -0.0544 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0358 -0.3700 -0.1629 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7459 -0.0737 0.9678 C 0 0 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2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 6 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 21 24 1 0 24 25 1 0 24 26 1 0 26 27 1 0 26 28 1 0 28 29 1 0 17 30 1 0 30 31 1 0 31 32 1 0 32 33 1 0 32 34 1 0 34 35 1 0 35 36 1 0 36 37 1 0 37 38 1 0 3 39 1 0 39 40 1 0 39 41 1 0 37 8 1 0 37 11 1 0 34 12 1 0 32 15 1 0 28 19 1 0 1 42 1 0 1 43 1 0 1 44 1 0 2 45 1 0 2 46 1 0 3 47 1 0 4 48 1 0 4 49 1 0 5 50 1 0 5 51 1 0 6 52 1 0 7 53 1 0 7 54 1 0 7 55 1 0 8 56 1 0 9 57 1 0 9 58 1 0 10 59 1 0 10 60 1 0 11 61 1 0 12 62 1 0 13 63 1 0 13 64 1 0 14 65 1 0 16 66 1 0 16 67 1 0 17 68 1 0 19 69 1 0 21 70 1 0 22 71 1 0 22 72 1 0 23 73 1 0 24 74 1 0 25 75 1 0 26 76 1 0 27 77 1 0 28 78 1 0 29 79 1 0 30 80 1 0 30 81 1 0 31 82 1 0 31 83 1 0 33 84 1 0 33 85 1 0 33 86 1 0 34 87 1 0 35 88 1 0 35 89 1 0 36 90 1 0 36 91 1 0 38 92 1 0 38 93 1 0 38 94 1 0 39 95 1 0 40 96 1 0 40 97 1 0 40 98 1 0 41 99 1 0 41100 1 0 41101 1 0 M END