HMDB0040700 RDKit 3D Dihydroferuperine 44 45 0 0 0 0 0 0 0 0999 V2000 4.6263 -3.3288 3.1333 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6532 -2.0255 3.7281 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3563 -1.3330 3.4335 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3357 -0.6230 2.4441 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9718 0.3247 1.8277 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6307 0.7843 0.8272 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9756 1.1266 -0.3849 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6044 0.9219 -0.4652 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3968 1.0817 -1.2346 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8381 1.5555 -2.4704 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1328 2.0786 -3.3625 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2527 1.4646 -2.8069 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2517 0.8380 -2.0061 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0488 -0.2142 -2.7824 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3788 0.2532 -4.1581 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0974 1.7154 -4.3739 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6863 2.1252 -4.0017 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2766 -0.1605 2.8841 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1251 -0.9107 4.0272 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3333 -1.6808 4.4537 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8263 -1.2173 5.6942 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7665 -3.8473 3.5953 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4528 -3.1678 2.0515 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5641 -3.8953 3.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1595 -0.4910 1.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6810 1.1104 0.6079 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6045 1.5269 -1.1615 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1730 0.4082 0.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2823 0.6272 -0.6226 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9558 0.3597 -1.0937 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0342 1.6488 -1.8138 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4789 -1.1618 -2.8704 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9756 -0.4902 -2.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9220 -0.3756 -4.9487 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4926 0.1242 -4.3078 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8336 2.3050 -3.7917 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2933 1.9267 -5.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7235 3.2319 -3.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0662 2.0441 -4.8806 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2442 0.4674 2.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2754 -1.6667 4.0019 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8598 -0.2279 4.9415 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1540 -2.7561 4.4802 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4911 -0.4768 5.5763 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 10 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 5 18 2 0 18 19 1 0 19 20 1 0 20 21 1 0 20 3 1 0 17 12 1 0 1 22 1 0 1 23 1 0 1 24 1 0 4 25 1 0 6 26 1 0 7 27 1 0 8 28 1 0 9 29 1 0 13 30 1 0 13 31 1 0 14 32 1 0 14 33 1 0 15 34 1 0 15 35 1 0 16 36 1 0 16 37 1 0 17 38 1 0 17 39 1 0 18 40 1 0 19 41 1 0 19 42 1 0 20 43 1 0 21 44 1 0 M END