HMDB0040825 RDKit 3D Tryptophol [xylosyl-(1->6)-glucoside] 61 64 0 0 0 0 0 0 0 0999 V2000 -6.5659 1.5952 1.3112 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9965 0.2659 1.1625 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1255 -0.7028 1.8966 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2446 -1.4114 1.1786 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6573 -0.8694 0.0828 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4508 -0.2217 0.3460 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3833 -0.7872 -0.3064 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0814 -0.1129 -0.0318 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 -0.7263 -0.7333 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1490 -0.2022 -0.2252 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2486 -1.0295 -0.3797 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7731 -1.4755 0.8191 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9616 -2.3671 0.6517 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0863 -1.7326 -0.0396 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4741 -1.9286 -1.3491 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5470 -1.1550 -1.5851 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8824 -0.4599 -0.4912 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8853 0.4450 -0.2384 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0171 1.0285 0.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1127 0.6898 2.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1141 -0.2209 1.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9737 -0.8147 0.4827 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3717 1.1763 -0.7452 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2343 1.2137 -1.8386 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0772 1.7906 -1.1586 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0978 3.1796 -1.1854 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0992 1.3700 -0.2806 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2470 1.8317 -0.8828 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5024 0.0869 -0.7056 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2665 -0.0631 -2.0561 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9555 -0.0575 -0.3334 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7174 0.8156 -1.0756 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7946 1.9793 2.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0617 0.2459 1.4604 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6528 -0.1502 2.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8306 -1.4286 2.4029 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4040 -1.7042 -0.6083 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5771 -0.8125 -1.3947 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3648 -1.8670 0.0205 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8347 -0.2602 1.0471 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9892 -0.1225 0.8899 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0255 -1.9999 1.4428 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1013 -0.5869 1.3967 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6924 -3.3643 0.2128 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3182 -2.6198 1.6933 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0102 -2.5770 -2.0526 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0354 -1.1201 -2.5116 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5777 0.7019 -1.0179 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8218 1.7323 1.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2245 1.1575 2.9727 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4212 -0.4838 2.4883 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8323 1.7960 0.0627 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0571 0.4151 -2.3777 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2189 1.4700 -2.1995 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2475 3.5585 -2.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9720 1.9543 0.6696 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4868 1.2344 -1.6348 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2108 1.1455 -0.4495 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6793 0.6395 -2.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2476 -1.1023 -0.4864 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2205 1.4191 -0.4766 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 13 14 1 0 14 15 2 0 15 16 1 0 16 17 1 0 17 18 2 0 18 19 1 0 19 20 2 0 20 21 1 0 21 22 2 0 10 23 1 0 23 24 1 0 23 25 1 0 25 26 1 0 25 27 1 0 27 28 1 0 5 29 1 0 29 30 1 0 29 31 1 0 31 32 1 0 31 2 1 0 27 8 1 0 22 14 1 0 22 17 1 0 1 33 1 0 2 34 1 0 3 35 1 0 3 36 1 0 5 37 1 0 7 38 1 0 7 39 1 0 8 40 1 0 10 41 1 0 12 42 1 0 12 43 1 0 13 44 1 0 13 45 1 0 15 46 1 0 16 47 1 0 18 48 1 0 19 49 1 0 20 50 1 0 21 51 1 0 23 52 1 0 24 53 1 0 25 54 1 0 26 55 1 0 27 56 1 0 28 57 1 0 29 58 1 0 30 59 1 0 31 60 1 0 32 61 1 0 M END