HMDB0258335 RDKit 3D Skullcapflavone II 45 47 0 0 0 0 0 0 0 0999 V2000 5.1885 -2.2466 1.3258 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0267 -1.6164 0.8934 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9449 -0.5379 0.0706 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1689 -0.0085 -0.3884 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2377 1.0781 -1.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0730 1.6731 -1.6292 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8757 1.1628 -1.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7102 1.7735 -1.6032 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7934 0.0485 -0.3286 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4698 -0.4194 0.0876 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2715 -1.4818 0.9103 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0209 -1.8851 1.2756 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1479 -2.8649 2.0318 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0688 -1.1639 0.7687 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3712 -1.4932 1.0777 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7028 -2.5306 1.8870 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3805 -0.6944 0.5097 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6898 -1.0390 0.8308 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4264 -1.9535 0.0465 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1401 0.3671 -0.3141 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1935 1.1248 -0.8487 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6594 2.2418 -0.1262 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8376 0.6855 -0.6148 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5685 1.7615 -1.4509 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3924 3.0459 -0.8841 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8021 -0.0842 -0.0702 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4087 0.2495 -0.3786 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8575 -2.4193 0.4671 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7811 -1.6192 2.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9552 -3.2352 1.7637 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0946 -0.4574 -0.0848 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1857 1.4802 -1.5734 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1456 2.5265 -2.2863 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7112 2.5751 -2.2175 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1091 -2.0675 1.3225 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2632 -3.2097 2.3881 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8314 -2.8676 -0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2623 -2.3149 0.6971 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8875 -1.5007 -0.8396 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1958 2.2988 0.8985 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4514 3.2057 -0.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7662 2.1626 0.0769 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1877 3.7559 -1.1938 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4255 3.4715 -1.2591 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3361 3.0227 0.2223 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 2 0 6 7 1 0 7 8 1 0 7 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 12 14 1 0 14 15 2 0 15 16 1 0 15 17 1 0 17 18 1 0 18 19 1 0 17 20 2 0 20 21 1 0 21 22 1 0 20 23 1 0 23 24 1 0 24 25 1 0 23 26 2 0 26 27 1 0 9 3 1 0 27 10 1 0 26 14 1 0 1 28 1 0 1 29 1 0 1 30 1 0 4 31 1 0 5 32 1 0 6 33 1 0 8 34 1 0 11 35 1 0 16 36 1 0 19 37 1 0 19 38 1 0 19 39 1 0 22 40 1 0 22 41 1 0 22 42 1 0 25 43 1 0 25 44 1 0 25 45 1 0 M END