HMDB0012177 RDKit 3D 5-Methyltetrahydropteroyltri-L-glutamic acid 90 92 0 0 0 0 0 0 0 0999 V2000 -9.6772 -1.1560 2.6464 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7294 -0.4011 1.4211 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.7430 0.5901 1.1963 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0629 1.0271 -0.0659 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0198 1.9611 -0.2911 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.6836 2.4825 0.7532 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.6999 3.4625 0.5932 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.3713 2.0540 2.0093 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.4324 1.1358 2.2522 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1448 0.7414 3.4145 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.3433 0.4593 -1.1674 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.5794 -0.7401 -0.9504 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7632 -0.6147 0.3459 C 0 0 2 0 0 0 0 0 0 0 0 0 -8.0068 -1.8874 0.5446 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0236 -2.1791 -0.4688 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7922 -1.5080 -0.6184 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3538 -0.4772 0.1817 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1267 0.1232 0.0007 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2741 -0.2905 -1.0046 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9711 0.3492 -1.1995 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8656 1.6002 -1.0293 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8646 -0.4454 -1.5701 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4313 0.2241 -1.7504 C 0 0 1 0 0 0 0 0 0 0 0 0 1.3688 -0.4266 -0.7739 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7628 0.1219 -0.7898 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5729 -0.6082 0.2161 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0100 -1.5203 0.8967 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9400 -0.2966 0.4136 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6981 -1.0368 1.4110 C 0 0 1 0 0 0 0 0 0 0 0 0 6.8152 -1.8029 0.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8441 -1.0861 0.0376 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6506 -0.0880 0.7408 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5689 0.2491 1.9360 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6729 0.5967 -0.0379 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4874 1.5806 0.6244 C 0 0 1 0 0 0 0 0 0 0 0 0 11.8844 1.1085 0.9549 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7177 0.7052 -0.2014 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2125 -0.4438 -0.9793 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4048 -0.4386 -2.2310 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5462 -1.5286 -0.4451 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5017 2.8419 -0.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8420 2.9394 -1.1867 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2414 3.9128 0.3197 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9464 -0.2033 2.5735 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6599 1.0314 2.6089 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5218 -0.7309 3.7438 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9257 0.0480 -3.1373 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2174 -0.6473 -3.9269 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0894 0.5876 -3.6146 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6988 -1.3213 -1.8149 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9241 -1.9074 -1.6204 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0497 -2.0662 2.5714 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1849 -0.5404 3.4572 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7195 -1.4535 2.9189 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2335 2.2665 -1.2535 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6400 4.1391 -0.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.4828 3.4800 1.2525 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3987 0.9419 -2.1018 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8782 -0.8514 -1.7959 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2218 -1.6338 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0 0 12.3828 1.9646 1.4567 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8662 0.3012 1.7108 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7117 0.3689 0.2209 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9491 1.5523 -0.8944 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4204 -2.4020 -0.9346 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9586 4.3662 -0.2334 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9763 -1.6415 3.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1735 1.3300 -4.2995 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0094 -1.6277 -2.5944 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2123 -2.7087 -2.2765 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 1 0 6 7 1 0 6 8 2 0 8 9 1 0 9 10 2 0 4 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 2 0 17 18 1 0 18 19 2 0 19 20 1 0 20 21 2 0 20 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 26 27 2 0 26 28 1 0 28 29 1 0 29 30 1 0 30 31 1 0 31 32 1 0 32 33 2 0 32 34 1 0 34 35 1 0 35 36 1 0 36 37 1 0 37 38 1 0 38 39 2 0 38 40 1 0 35 41 1 0 41 42 2 0 41 43 1 0 29 44 1 0 44 45 2 0 44 46 1 0 23 47 1 0 47 48 2 0 47 49 1 0 19 50 1 0 50 51 2 0 13 2 1 0 51 16 1 0 9 3 1 0 1 52 1 0 1 53 1 0 1 54 1 0 5 55 1 0 7 56 1 0 7 57 1 0 11 58 1 0 12 59 1 0 12 60 1 0 13 61 1 6 14 62 1 0 14 63 1 0 15 64 1 0 17 65 1 0 18 66 1 0 22 67 1 0 23 68 1 1 24 69 1 0 24 70 1 0 25 71 1 0 25 72 1 0 28 73 1 0 29 74 1 1 30 75 1 0 30 76 1 0 31 77 1 0 31 78 1 0 34 79 1 0 35 80 1 1 36 81 1 0 36 82 1 0 37 83 1 0 37 84 1 0 40 85 1 0 43 86 1 0 46 87 1 0 49 88 1 0 50 89 1 0 51 90 1 0 M END