HMDB0041323 RDKit 3D Heteroartonin A 61 63 0 0 0 0 0 0 0 0999 V2000 4.4202 2.1431 -1.7971 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9560 1.7998 -0.4906 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6545 1.3029 -0.4329 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5673 2.1061 -0.2671 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7520 3.4738 -0.1495 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2477 1.6010 -0.2097 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0103 0.2706 -0.3183 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2733 -0.4014 -0.1761 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3086 -1.6006 -0.8156 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3114 -2.3875 -0.8312 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2439 -3.5988 -1.5231 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3128 -4.4431 -1.5445 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2031 -5.6443 -2.2487 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4719 -4.1397 -0.8994 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5773 -2.9258 -0.1904 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7275 -2.6377 0.4431 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4972 -2.0790 -0.1726 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5003 -0.8781 0.4835 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4817 -0.4764 1.1086 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3807 -0.0140 0.4912 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4948 1.2765 1.1826 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0772 2.3658 0.3714 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1074 3.0319 0.8405 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7539 2.7761 2.1536 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6627 4.1350 -0.0312 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1557 -0.5495 -0.4909 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9360 -1.8957 -0.6021 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4296 -0.0481 -0.5454 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6120 -0.9396 -0.7061 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3203 -1.1634 0.5846 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5738 -0.8951 0.8159 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1278 -1.1836 2.1791 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5292 -0.3240 -0.1688 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4636 1.7993 -1.9413 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7711 1.7768 -2.5962 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3694 3.2711 -1.8659 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6846 3.8488 -0.1911 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5034 2.3492 -0.1112 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3062 -3.8220 -2.0317 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8638 -6.4445 -1.7468 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3291 -4.7759 -0.8954 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9970 -1.8844 0.9692 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5675 1.6383 1.6619 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1768 1.1345 2.1048 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6830 2.5978 -0.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3252 1.8490 2.2176 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0288 2.8041 3.0054 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4668 3.6181 2.3723 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7969 4.7514 -0.3452 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9943 3.6158 -0.9651 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4748 4.6852 0.4464 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5873 -2.6349 -0.7262 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3889 -1.9031 -1.1847 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3641 -0.4550 -1.3967 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7219 -1.5950 1.4105 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6208 -0.2542 2.5588 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3179 -1.4491 2.8911 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8403 -2.0139 2.0938 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5712 -0.6895 0.0794 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3614 -0.6475 -1.1985 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5446 0.7725 -0.0701 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 4 6 1 0 6 7 2 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 1 0 12 14 2 0 14 15 1 0 15 16 1 0 15 17 2 0 17 18 1 0 18 19 2 0 18 20 1 0 20 21 1 0 21 22 1 0 22 23 2 3 23 24 1 0 23 25 1 0 7 26 1 0 26 27 1 0 26 28 2 0 28 29 1 0 29 30 1 0 30 31 2 3 31 32 1 0 31 33 1 0 28 3 1 0 20 8 2 0 17 10 1 0 1 34 1 0 1 35 1 0 1 36 1 0 5 37 1 0 6 38 1 0 11 39 1 0 13 40 1 0 14 41 1 0 16 42 1 0 21 43 1 0 21 44 1 0 22 45 1 0 24 46 1 0 24 47 1 0 24 48 1 0 25 49 1 0 25 50 1 0 25 51 1 0 27 52 1 0 29 53 1 0 29 54 1 0 30 55 1 0 32 56 1 0 32 57 1 0 32 58 1 0 33 59 1 0 33 60 1 0 33 61 1 0 M END