HMDB0037494 RDKit 3D 3'-Deoxyoleacein 42 42 0 0 0 0 0 0 0 0999 V2000 -3.3524 1.4471 2.4799 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9825 1.0553 1.0782 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8138 0.2932 0.3283 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0369 -0.0623 1.0239 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9330 -0.7141 0.4951 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5133 -0.0877 -1.0334 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5073 -1.5463 -1.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7368 -2.2886 -1.2356 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7536 -3.2183 -0.4111 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1817 0.4849 -1.5466 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0026 -0.0027 -0.8245 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9855 -0.8825 0.0861 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2900 0.4952 -1.0987 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4382 0.0346 -0.4109 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6087 0.8137 -1.0074 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8885 0.4475 -0.3952 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3693 1.1075 0.7087 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5932 0.7244 1.2591 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3477 -0.3023 0.7324 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5735 -0.6645 1.3076 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8552 -0.9616 -0.3801 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6275 -0.5824 -0.9374 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4755 1.9597 2.9226 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1918 2.1576 2.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5285 0.5497 3.1192 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0841 1.4011 0.6344 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2464 0.2277 2.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2860 0.3952 -1.7044 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6318 -2.0662 -0.9131 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3040 -1.5368 -2.5316 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6551 -2.1127 -1.7689 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2086 1.5836 -1.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1009 0.1573 -2.6119 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4095 0.2687 0.6685 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6327 -1.0463 -0.6016 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3874 1.8959 -0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5879 0.5716 -2.1032 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7735 1.9124 1.1165 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9572 1.2486 2.1221 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4362 -0.2351 1.0054 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4298 -1.7735 -0.8135 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3063 -1.1487 -1.8107 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 2 0 3 6 1 0 6 7 1 0 7 8 1 0 8 9 2 0 6 10 1 0 10 11 1 0 11 12 2 0 11 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 2 0 17 18 1 0 18 19 2 0 19 20 1 0 19 21 1 0 21 22 2 0 22 16 1 0 1 23 1 0 1 24 1 0 1 25 1 0 2 26 1 0 4 27 1 0 6 28 1 0 7 29 1 0 7 30 1 0 8 31 1 0 10 32 1 0 10 33 1 0 14 34 1 0 14 35 1 0 15 36 1 0 15 37 1 0 17 38 1 0 18 39 1 0 20 40 1 0 21 41 1 0 22 42 1 0 M END