HMDB0245619 RDKit 3D 3-(5-Methylisoxazol-3-yl)-6-[(1-methyl-1H-1,2,3-triazol-4-yl)methoxy][1,2,4]t... 41 45 0 0 0 0 0 0 0 0999 V2000 5.3955 0.3217 4.2669 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3476 0.1860 3.2289 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5887 0.2191 1.8504 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3768 0.0616 1.2183 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1390 0.0322 -0.2204 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0238 0.1489 -1.2236 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4074 0.0698 -2.3907 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0927 -0.1022 -2.1705 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0411 -0.2385 -3.0475 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1579 -0.2217 -4.4194 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0559 -0.3647 -5.2495 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1914 -0.5282 -4.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3453 -0.5499 -3.3014 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2155 -0.4032 -2.5083 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3198 -0.4185 -1.1173 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6226 -0.5892 -0.6187 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7672 -0.6097 0.7872 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1892 -0.7958 1.1691 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0951 0.2280 1.3744 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2830 -0.3241 1.7066 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4852 0.4343 1.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1131 -1.6361 1.7052 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8671 -1.9381 1.3861 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7413 -0.2808 -0.3057 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9373 -0.1240 -0.8346 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4671 -0.0583 2.1996 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0583 0.0175 3.3719 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3699 -0.1190 3.9378 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5571 1.4069 4.4243 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0601 -0.1227 5.2316 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5243 0.3419 1.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1477 -0.0920 -4.8323 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1450 -0.3518 -6.3221 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0810 -0.6437 -5.2788 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3137 -0.6769 -2.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1630 -1.4210 1.2495 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3628 0.3397 1.2452 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8601 1.2793 1.2775 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3961 -0.1945 1.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4155 0.7451 3.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5481 1.3551 1.3925 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 1 0 5 6 2 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 2 0 19 20 1 0 20 21 1 0 20 22 1 0 22 23 2 0 15 24 2 0 24 25 1 0 4 26 2 0 26 27 1 0 27 2 1 0 25 5 1 0 25 8 1 0 14 9 1 0 23 18 1 0 1 28 1 0 1 29 1 0 1 30 1 0 3 31 1 0 10 32 1 0 11 33 1 0 12 34 1 0 13 35 1 0 17 36 1 0 17 37 1 0 19 38 1 0 21 39 1 0 21 40 1 0 21 41 1 0 M END