HMDB0060777 RDKit 3D 5-Hydroxyemedastine 49 51 0 0 0 0 0 0 0 0999 V2000 3.2366 3.4669 -0.4548 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8901 2.7494 0.7316 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9680 1.9194 1.3657 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4895 0.9677 0.4879 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4763 0.0663 1.2122 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9488 -0.9388 0.3398 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1532 -0.8608 -0.4114 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1047 0.1507 -0.5489 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0803 1.3584 0.1905 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1414 2.3580 -0.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5186 1.9279 0.1208 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1131 0.9766 -0.7702 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5193 0.8461 -0.4755 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4370 -0.3051 -0.7471 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1616 -0.1433 -1.5479 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2537 -2.0436 -1.0939 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7588 -2.8501 -0.7821 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1454 -4.1267 -1.1625 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2814 -4.7089 -0.6459 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6797 -5.9988 -1.0249 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0154 -3.9755 0.2601 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6843 -2.7191 0.6699 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5221 -2.1603 0.1223 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1528 3.6062 -0.2233 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7714 4.3978 -0.6514 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3241 2.7630 -1.3155 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3141 3.4714 1.4333 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7239 2.1323 0.3343 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1139 1.3476 -0.4606 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3531 0.2960 0.2376 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1364 -0.4696 1.9698 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7820 0.6066 1.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1535 1.9062 0.0703 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4206 1.2055 1.2523 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0451 2.5504 -1.3824 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9159 3.3119 0.2191 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1616 2.8297 0.1445 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4402 1.5517 1.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9974 1.8122 -0.8076 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9621 -0.0269 -0.9964 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6541 0.8173 0.6216 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2538 -0.6701 0.2836 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1372 -1.0278 -1.2486 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9578 -1.0801 -2.0764 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2202 0.7139 -2.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5139 -4.6312 -1.8768 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3721 -6.8216 -0.5299 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9125 -4.4208 0.6754 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2356 -2.1280 1.3713 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 12 14 1 0 14 15 1 0 7 16 2 0 16 17 1 0 17 18 2 0 18 19 1 0 19 20 1 0 19 21 2 0 21 22 1 0 22 23 2 0 23 6 1 0 15 8 1 0 23 17 1 0 1 24 1 0 1 25 1 0 1 26 1 0 2 27 1 0 2 28 1 0 4 29 1 0 4 30 1 0 5 31 1 0 5 32 1 0 9 33 1 0 9 34 1 0 10 35 1 0 10 36 1 0 11 37 1 0 11 38 1 0 13 39 1 0 13 40 1 0 13 41 1 0 14 42 1 0 14 43 1 0 15 44 1 0 15 45 1 0 18 46 1 0 20 47 1 0 21 48 1 0 22 49 1 0 M END