HMDB0033299 RDKit 3D 7-Hydroxy-3-(3-hydroxy-4-methoxybenzyl)-5-methoxy-4-chromanone 42 44 0 0 0 0 0 0 0 0999 V2000 6.8406 -0.7213 -0.1396 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9228 0.0810 0.5756 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5907 0.0277 0.2053 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1753 -0.7872 -0.8336 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8425 -0.8241 -1.1851 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9436 -0.0407 -0.4873 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5153 -0.0927 -0.8809 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2525 -1.1733 -0.1392 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2473 -0.9919 1.3451 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8135 0.2714 1.6359 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1009 0.4936 1.1635 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9547 1.3983 1.8038 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2264 1.6107 1.3282 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0346 2.5119 1.9909 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6608 0.9277 0.2144 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8556 0.0260 -0.4507 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2400 -0.6873 -1.5734 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5446 -0.4916 -2.0893 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5803 -0.1707 0.0469 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6641 -1.1083 -0.5985 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1123 -1.8287 -1.5249 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3580 0.7867 0.5656 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6929 0.8139 0.9065 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1467 1.6157 1.9391 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8517 -0.4508 -1.2042 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4475 -1.7741 -0.0853 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8410 -0.7502 0.3217 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8723 -1.4109 -1.3935 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5245 -1.4691 -2.0049 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0195 0.8951 -0.7893 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4768 -0.3586 -1.9564 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2179 -2.1476 -0.3965 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9065 -1.7825 1.7684 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7427 -1.1313 1.8107 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5773 1.9225 2.6845 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0091 3.4742 1.6999 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6734 1.0947 -0.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6578 -0.9674 -3.0852 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2627 -0.9617 -1.3685 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8252 0.5735 -2.1515 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6279 1.3970 1.1007 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5495 2.2003 2.4768 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 8 9 1 0 9 10 1 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 1 0 13 15 2 0 15 16 1 0 16 17 1 0 17 18 1 0 16 19 2 0 19 20 1 0 20 21 2 0 6 22 1 0 22 23 2 0 23 24 1 0 23 3 1 0 20 8 1 0 19 11 1 0 1 25 1 0 1 26 1 0 1 27 1 0 4 28 1 0 5 29 1 0 7 30 1 0 7 31 1 0 8 32 1 0 9 33 1 0 9 34 1 0 12 35 1 0 14 36 1 0 15 37 1 0 18 38 1 0 18 39 1 0 18 40 1 0 22 41 1 0 24 42 1 0 M END