HMDB0032955 RDKit 3D 5-(6-Hydroxy-3,7-dimethyl-2,7-octadienyloxy)-7-methoxycoumarin 49 50 0 0 0 0 0 0 0 0999 V2000 6.5473 1.2388 1.4076 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7472 1.1466 0.3643 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5785 2.3148 -0.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0158 -0.1203 0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4210 -0.5810 -1.1729 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5209 0.1454 0.1074 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7815 -1.1443 -0.1747 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3069 -0.9424 -0.1669 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4232 -2.0847 -0.4224 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7598 0.2260 0.0607 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6466 0.5842 0.1022 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5207 -0.4774 -0.1359 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9043 -0.3042 -0.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4000 0.9784 0.1198 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7515 1.2485 0.1442 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2297 2.5478 0.3999 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2636 3.5791 0.6336 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6182 0.2038 -0.0901 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1810 -1.0946 -0.3465 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0255 -2.0749 -0.5670 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6605 -3.3095 -0.8119 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5202 -4.2300 -1.0205 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3107 -3.5862 -0.8377 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3799 -2.5913 -0.6122 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8056 -1.3095 -0.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0678 2.1644 1.5911 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7085 0.4209 2.0962 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8420 2.1022 -1.3251 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5796 2.5296 -0.9874 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2933 3.1896 0.1045 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2504 -0.9051 0.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8251 -0.2880 -1.8886 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3256 0.9206 -0.6396 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2540 0.5042 1.1202 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1131 -1.9134 0.5425 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1222 -1.4830 -1.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1862 -2.2854 0.4814 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0074 -3.0111 -0.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1952 -1.9629 -1.3487 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4925 1.0446 0.2458 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8512 1.0956 1.0781 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8513 1.3776 -0.6685 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7134 1.7726 0.2986 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5801 3.5360 -0.2486 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6819 3.2561 1.5198 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7302 4.5536 0.7639 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6786 0.4009 -0.0739 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9718 -4.5853 -1.0349 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3261 -2.7973 -0.6302 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 4 6 1 0 6 7 1 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 2 0 14 15 1 0 15 16 1 0 16 17 1 0 15 18 2 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 2 0 21 23 1 0 23 24 2 0 24 25 1 0 25 13 1 0 25 19 2 0 1 26 1 0 1 27 1 0 3 28 1 0 3 29 1 0 3 30 1 0 4 31 1 0 5 32 1 0 6 33 1 0 6 34 1 0 7 35 1 0 7 36 1 0 9 37 1 0 9 38 1 0 9 39 1 0 10 40 1 0 11 41 1 0 11 42 1 0 14 43 1 0 17 44 1 0 17 45 1 0 17 46 1 0 18 47 1 0 23 48 1 0 24 49 1 0 M END