HMDB0036293 RDKit 3D Cholesteryl ferulate 95 99 0 0 0 0 0 0 0 0999 V2000 13.2224 0.3524 1.7341 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2394 0.4904 0.3306 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0769 0.4907 -0.4363 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8885 0.3508 0.2175 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6975 0.3465 -0.5193 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4346 0.1941 0.1815 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2819 0.1918 -0.4472 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0325 0.0338 0.3112 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0947 -0.0995 1.5521 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8038 0.0267 -0.2838 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5647 -0.1271 0.4324 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9151 -1.3430 -0.1243 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4647 -1.5125 0.1181 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8820 -0.3741 0.8839 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3780 -0.4628 2.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3389 0.8944 0.2391 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5532 1.7773 -0.3557 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9479 1.6091 -0.4615 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1333 0.1324 -0.4022 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6113 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0 31 33 1 0 25 34 1 0 34 35 1 0 35 36 1 0 16 37 1 0 5 38 2 0 38 39 1 0 39 40 2 0 40 41 1 0 40 3 1 0 37 11 1 0 20 14 1 0 36 23 1 0 36 19 1 0 1 42 1 0 1 43 1 0 1 44 1 0 4 45 1 0 6 46 1 0 7 47 1 0 11 48 1 0 12 49 1 0 12 50 1 0 13 51 1 0 13 52 1 0 15 53 1 0 15 54 1 0 15 55 1 0 17 56 1 0 18 57 1 0 18 58 1 0 19 59 1 0 20 60 1 0 21 61 1 0 21 62 1 0 22 63 1 0 22 64 1 0 24 65 1 0 24 66 1 0 24 67 1 0 25 68 1 0 26 69 1 0 27 70 1 0 27 71 1 0 27 72 1 0 28 73 1 0 28 74 1 0 29 75 1 0 29 76 1 0 30 77 1 0 30 78 1 0 31 79 1 0 32 80 1 0 32 81 1 0 32 82 1 0 33 83 1 0 33 84 1 0 33 85 1 0 34 86 1 0 34 87 1 0 35 88 1 0 35 89 1 0 36 90 1 0 37 91 1 0 37 92 1 0 38 93 1 0 39 94 1 0 41 95 1 0 M END