HMDB0302550 RDKit 3D 5-Hexyl-2-methylpyridine 42 43 0 0 0 0 0 0 0 0999 V2000 -4.2151 2.7146 0.2496 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6598 1.7510 -0.7989 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3396 0.3170 -0.4625 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8836 0.0615 -0.2845 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6569 -1.3126 0.0309 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3569 -1.8612 0.2591 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1469 -3.1831 0.5618 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1074 -3.7141 0.7824 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3151 -5.1493 1.1094 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1553 -2.8588 0.6865 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9675 -1.5526 0.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0880 -0.6729 0.2940 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8714 0.7241 -0.0255 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1873 1.4052 -0.0612 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7239 1.9787 1.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9520 2.5996 0.9716 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6204 2.6389 -0.2264 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1093 2.0750 -1.3639 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8755 1.4551 -1.2586 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2767 -1.0651 0.1787 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1693 3.0731 0.1177 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8534 3.6380 0.1408 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4055 2.3431 1.2694 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7500 1.8767 -0.9515 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1918 2.0284 -1.7808 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7334 -0.3574 -1.2471 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8803 0.0707 0.4653 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3054 0.3534 -1.2027 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4672 0.6633 0.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4898 -1.9609 0.1003 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0019 -3.8371 0.6306 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5371 -5.6995 0.6489 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1858 -5.2532 2.2078 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2946 -5.5245 0.7518 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0604 -1.0421 0.4558 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3782 0.8242 -1.0238 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1994 1.2269 0.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2053 1.9578 2.0286 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3930 3.0604 1.8542 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5846 3.1239 -0.3069 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6135 2.0920 -2.3165 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4325 0.9920 -2.1457 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 2 0 7 8 1 0 8 9 1 0 8 10 2 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 2 0 17 18 1 0 18 19 2 0 11 20 2 0 20 6 1 0 19 14 1 0 1 21 1 0 1 22 1 0 1 23 1 0 2 24 1 0 2 25 1 0 3 26 1 0 3 27 1 0 4 28 1 0 4 29 1 0 5 30 1 0 7 31 1 0 9 32 1 0 9 33 1 0 9 34 1 0 12 35 1 0 13 36 1 0 13 37 1 0 15 38 1 0 16 39 1 0 17 40 1 0 18 41 1 0 19 42 1 0 M END