HMDB0302978 RDKit 3D Oxyglutinosone 37 38 0 0 0 0 0 0 0 0999 V2000 3.9842 -0.7988 0.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8947 -0.4788 -0.1744 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8622 -0.7482 -1.6424 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7582 0.1326 0.5508 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6142 1.5399 0.0185 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4240 2.2518 0.5653 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7803 1.4394 0.2258 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8110 2.0828 -0.3485 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9908 1.3073 -0.6846 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8866 1.7489 -1.4338 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1168 -0.0504 -0.1091 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1800 -0.7601 -0.6324 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7890 -0.7342 -0.3505 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8066 -2.1927 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7739 0.0127 0.5332 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3090 -0.1126 1.8393 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5304 -0.6869 0.4427 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8389 -1.2472 0.0256 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0758 -0.6314 1.5781 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7519 -1.8497 -1.7497 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0025 -0.2350 -2.0804 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8376 -0.4839 -2.0656 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0290 0.2369 1.6144 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6193 1.4988 -1.0763 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5260 2.0988 0.3655 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5366 2.2939 1.6853 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3788 3.2535 0.1219 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7346 3.1447 -0.5422 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2097 0.0820 1.0065 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9902 -0.5664 -0.0893 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4758 -0.5882 -1.4038 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2501 -2.7588 -0.8154 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8384 -2.5985 -0.0409 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2771 -2.3975 0.9284 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5966 -0.4223 2.4375 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5907 -1.3393 -0.4783 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5618 -1.4429 1.2839 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 3 2 3 1 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 2 0 9 11 1 0 11 12 1 0 11 13 1 0 13 14 1 0 13 15 1 0 15 16 1 0 15 17 1 0 17 4 1 0 15 7 1 0 1 18 1 0 1 19 1 0 3 20 1 0 3 21 1 0 3 22 1 0 4 23 1 0 5 24 1 0 5 25 1 0 6 26 1 0 6 27 1 0 8 28 1 0 11 29 1 0 12 30 1 0 13 31 1 0 14 32 1 0 14 33 1 0 14 34 1 0 16 35 1 0 17 36 1 0 17 37 1 0 M END