HMDB0040940 RDKit 3D Capsiamide 54 53 0 0 0 0 0 0 0 0999 V2000 7.4157 0.9701 0.4542 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9745 0.9328 0.8449 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2897 2.1477 0.9537 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3408 -0.1467 1.0829 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9481 -0.1618 1.4592 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2322 -1.3671 0.8466 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3510 -1.2596 -0.6294 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8310 -0.0987 -1.3189 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4594 0.3839 -1.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4492 -0.5447 -1.9266 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1084 -1.6890 -1.0696 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4873 -1.3587 0.2306 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7883 -0.7021 0.3889 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9926 0.6666 -0.0886 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4002 1.1720 0.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4035 0.3011 -0.4325 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8379 0.7846 -0.1539 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7547 -0.1775 -0.8793 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1300 0.8275 1.3098 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4800 0.8724 -0.6384 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8924 0.0861 0.9284 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8927 1.9233 0.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7789 3.0450 0.8963 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9104 -0.2468 2.5647 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4608 0.7582 1.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2619 -1.4649 1.2929 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8569 -2.2707 1.1744 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2198 -2.2438 -1.1736 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5248 -1.1677 -0.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2482 -0.1742 -2.4047 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4700 0.8127 -0.9532 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3861 1.3435 -1.9807 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0760 0.7423 -0.3592 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9675 -1.0206 -2.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4020 -0.0230 -2.3917 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5643 -2.4129 -1.6562 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0243 -2.3382 -0.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2367 -0.7145 0.8401 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5473 -2.3309 0.8378 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9884 -0.6732 1.5206 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5520 -1.4328 -0.0403 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7563 0.8892 -1.1148 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3293 1.3465 0.5366 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5505 1.3004 1.3103 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4554 2.1879 -0.2196 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3961 -0.7388 -0.0464 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2850 0.3685 -1.5327 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8869 1.8008 -0.5946 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2144 -1.0746 -1.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2394 0.2883 -1.7647 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5212 -0.5861 -0.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3931 0.2082 1.8837 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1274 0.3729 1.4848 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0841 1.8871 1.6504 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 2 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 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 17 19 1 0 1 20 1 0 1 21 1 0 1 22 1 0 3 23 1 0 5 24 1 0 5 25 1 0 6 26 1 0 6 27 1 0 7 28 1 0 7 29 1 0 8 30 1 0 8 31 1 0 9 32 1 0 9 33 1 0 10 34 1 0 10 35 1 0 11 36 1 0 11 37 1 0 12 38 1 0 12 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 16 46 1 0 16 47 1 0 17 48 1 0 18 49 1 0 18 50 1 0 18 51 1 0 19 52 1 0 19 53 1 0 19 54 1 0 M END