HMDB0037652 RDKit 3D Prodelphinidin B 70 75 0 0 0 0 0 0 0 0999 V2000 4.2410 -3.8464 3.6752 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3912 -3.0597 2.9019 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0321 -3.0120 3.1096 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1991 -2.2364 2.3459 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1841 -2.1892 2.5588 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7440 -1.4632 1.3167 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0982 -1.4742 1.0672 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8869 -2.2821 1.8775 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6296 -0.6948 0.0355 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0137 0.5682 -0.1437 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5821 1.2925 -1.3072 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8666 2.6271 -1.1635 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4053 3.4210 -2.1799 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6502 4.7580 -1.9165 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6581 2.8156 -3.3838 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1904 3.5515 -4.4243 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3694 1.4569 -3.5328 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6210 0.8340 -4.7461 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8393 0.7033 -2.5123 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5497 0.3435 -0.4202 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4635 -0.0621 -1.7713 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8580 -0.6314 0.4707 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0513 -1.4800 -0.3568 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3770 -2.3965 -1.2801 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7240 -2.5929 -1.4728 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5119 -3.1383 -2.0293 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8780 -2.9972 -1.8878 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8145 -3.7160 -2.6139 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3361 -2.0644 -0.9469 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4479 -1.3319 -0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9535 -0.4235 0.7074 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1798 0.2287 0.3783 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5840 1.1774 1.4254 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6949 2.0389 1.9922 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0265 2.9484 2.9789 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0817 3.7951 3.5141 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3444 2.9712 3.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6628 3.8873 4.3930 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2607 2.1137 2.8495 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5719 2.1756 3.3106 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8893 1.2044 1.8507 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2465 -0.7461 0.0083 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2517 -0.0689 -0.7106 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7939 -1.9128 -0.7818 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4033 -4.7909 3.3468 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6406 -3.6191 3.9107 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5554 -2.7588 3.3111 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9629 -2.2808 1.6621 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1181 1.2186 0.7743 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6672 3.1176 -0.2044 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0294 5.3777 -2.5874 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4111 4.5279 -4.3565 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0092 1.3133 -5.5474 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6157 -0.3475 -2.6244 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0975 1.3773 -0.3263 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7227 0.4323 -2.2018 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1732 -0.0434 1.1524 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0758 -3.2598 -2.1448 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1365 -3.8617 -2.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5008 -4.3812 -3.2849 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9833 0.8541 -0.5428 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6704 2.0282 1.6686 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3695 4.4437 4.2334 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6061 3.9183 4.7118 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3050 1.5694 2.9447 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6832 0.5757 1.4814 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7180 -1.1270 0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5647 -0.6097 -1.4643 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1947 -2.8926 -0.3748 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2638 -1.8737 -1.8154 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 1 0 4 6 2 0 6 7 1 0 7 8 2 0 7 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 15 17 1 0 17 18 1 0 17 19 2 0 10 20 1 0 20 21 1 0 20 22 1 0 22 23 1 0 23 24 2 0 24 25 1 0 24 26 1 0 26 27 2 0 27 28 1 0 27 29 1 0 29 30 2 0 30 31 1 0 31 32 1 0 32 33 1 0 33 34 2 0 34 35 1 0 35 36 1 0 35 37 2 0 37 38 1 0 37 39 1 0 39 40 1 0 39 41 2 0 32 42 1 0 42 43 1 0 42 44 1 0 8 2 1 0 19 11 1 0 30 23 1 0 41 33 1 0 22 6 1 0 44 29 1 0 1 45 1 0 3 46 1 0 5 47 1 0 8 48 1 0 10 49 1 0 12 50 1 0 14 51 1 0 16 52 1 0 18 53 1 0 19 54 1 0 20 55 1 0 21 56 1 0 22 57 1 0 25 58 1 0 26 59 1 0 28 60 1 0 32 61 1 0 34 62 1 0 36 63 1 0 38 64 1 0 40 65 1 0 41 66 1 0 42 67 1 0 43 68 1 0 44 69 1 0 44 70 1 0 M END