HMDB0030572 RDKit 3D (±)-Anisoxide 33 34 0 0 0 0 0 0 0 0999 V2000 4.7571 -0.9185 0.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3691 0.0093 -0.6031 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1536 0.3582 -0.8356 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9759 -0.0662 -0.1579 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7947 -1.0772 0.7362 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5762 -1.3401 1.3856 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5219 -0.5542 1.1293 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3682 0.4723 0.2301 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8173 0.7144 -0.3897 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7244 1.1332 0.1758 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0294 1.6540 -1.1885 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6104 -0.0123 0.5909 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6815 -0.9915 -0.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9601 0.4335 1.0722 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8222 -0.5902 1.6208 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9001 -0.7897 0.6035 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6683 -1.9931 0.2185 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4020 -0.6475 1.4756 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2082 0.4264 -1.2341 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0345 1.0758 -1.6845 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5845 -1.7496 0.9607 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5158 -2.1742 2.0935 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8420 1.5580 -1.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6855 1.9363 0.9346 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5406 1.0525 -1.9838 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6165 2.6930 -1.2746 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1326 1.6473 -1.3554 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6356 -1.3311 -0.7467 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0533 -0.5576 -1.4799 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2423 -1.9216 -0.2608 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6222 0.4973 0.1684 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3962 -0.3585 1.7264 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9562 1.4115 1.5598 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 2 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 8 10 1 0 10 11 1 0 10 12 1 0 12 13 1 0 12 14 1 0 12 15 1 0 9 4 1 0 15 7 1 0 1 16 1 0 1 17 1 0 1 18 1 0 2 19 1 0 3 20 1 0 5 21 1 0 6 22 1 0 9 23 1 0 10 24 1 0 11 25 1 0 11 26 1 0 11 27 1 0 13 28 1 0 13 29 1 0 13 30 1 0 14 31 1 0 14 32 1 0 14 33 1 0 M END