HMDB0035307 RDKit 3D Quercuslactone a 27 27 0 0 0 0 0 0 0 0999 V2000 4.0747 -0.2032 -0.2816 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8209 -0.8492 0.2649 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6359 -0.0606 -0.2238 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3245 -0.6136 0.2598 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7600 0.2791 -0.3103 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5529 1.5909 0.1604 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7192 2.2009 0.5323 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9110 3.3166 1.0764 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8272 1.2795 0.1716 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1216 -0.0710 0.2344 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8301 -1.1256 -0.5445 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6228 0.3117 0.5603 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8345 0.6083 -1.0248 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7504 -0.9612 -0.6907 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7553 -1.8866 -0.1771 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8740 -0.9360 1.3494 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6109 -0.0798 -1.3314 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7167 0.9768 0.1713 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1493 -1.6575 -0.0599 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2279 -0.5763 1.3646 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7205 0.2706 -1.4032 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2168 1.4726 -0.8583 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6285 1.2597 0.9326 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9972 -0.3007 1.3109 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3163 -1.4364 -1.4652 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8748 -0.7829 -0.7885 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9217 -2.0262 0.1069 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 2 0 7 9 1 0 9 10 1 0 10 11 1 0 10 5 1 0 1 12 1 0 1 13 1 0 1 14 1 0 2 15 1 0 2 16 1 0 3 17 1 0 3 18 1 0 4 19 1 0 4 20 1 0 5 21 1 0 9 22 1 0 9 23 1 0 10 24 1 0 11 25 1 0 11 26 1 0 11 27 1 0 M END