HMDB0030665 RDKit 3D 3,5-Digalloylepicatechin 65 69 0 0 0 0 0 0 0 0999 V2000 -4.3746 -0.2305 1.4872 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1402 0.5023 0.4944 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4583 -0.0497 -0.5590 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0126 -1.3782 -0.5858 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8309 -2.3683 -1.0857 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4766 -3.6983 -1.1511 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3454 -4.6707 -1.6692 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2129 -4.0321 -0.6776 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3616 -3.0621 -0.1672 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7749 -1.7467 -0.1287 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8451 -0.7385 0.4205 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5808 -1.2566 0.0323 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4821 -0.2148 0.0596 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0103 0.3576 -1.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6277 -0.1196 -2.1903 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9561 1.4500 -1.0957 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4522 1.9866 -2.2603 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3558 3.0298 -2.2662 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8353 3.5456 -3.4828 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7867 3.5642 -1.0798 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6912 4.6092 -1.0591 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3086 3.0491 0.1095 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7400 3.5853 1.3336 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4086 2.0091 0.0806 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7905 -2.4496 0.8659 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1035 -3.0793 0.9082 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1875 -4.4632 1.1484 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3623 -5.1452 1.2266 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5592 -4.4808 1.0675 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7761 -5.1725 1.1456 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5280 -3.1262 0.8309 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7254 -2.4033 0.6614 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3056 -2.4471 0.7552 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1038 -3.4603 0.2935 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6071 1.8872 0.5276 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3949 2.7645 -0.5153 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8381 4.0734 -0.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6243 4.9580 -1.5313 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5191 4.5556 0.6177 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9718 5.8836 0.6599 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7395 3.6934 1.6677 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4217 4.1639 2.7759 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2896 2.3851 1.6177 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8071 -2.0891 -1.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9606 -5.1060 -1.0048 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9018 -5.0752 -0.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9920 0.2712 0.0364 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8660 -0.8177 1.5191 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4376 -1.5492 -1.0541 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1485 1.6056 -3.2337 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4926 4.3049 -3.4708 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0076 5.0021 -0.1808 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3802 3.1961 2.1851 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0395 1.6115 1.0013 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3803 -2.2962 1.9104 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2594 -5.0026 1.2761 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4092 -6.2146 1.4128 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7477 -6.1638 1.3205 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6186 -2.8718 0.7119 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3878 -1.3859 0.5803 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8613 2.3859 -1.3747 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1185 4.5969 -2.3443 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8085 6.5139 -0.1125 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7532 5.1116 2.8239 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4705 1.7128 2.4555 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 1 0 4 5 2 0 5 6 1 0 6 7 1 0 6 8 2 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 2 0 14 16 1 0 16 17 2 0 17 18 1 0 18 19 1 0 18 20 2 0 20 21 1 0 20 22 1 0 22 23 1 0 22 24 2 0 12 25 1 0 25 26 1 0 26 27 2 0 27 28 1 0 28 29 2 0 29 30 1 0 29 31 1 0 31 32 1 0 31 33 2 0 25 34 1 0 2 35 1 0 35 36 2 0 36 37 1 0 37 38 1 0 37 39 2 0 39 40 1 0 39 41 1 0 41 42 1 0 41 43 2 0 10 4 1 0 24 16 1 0 33 26 1 0 43 35 1 0 34 9 1 0 5 44 1 0 7 45 1 0 8 46 1 0 11 47 1 0 11 48 1 0 12 49 1 0 17 50 1 0 19 51 1 0 21 52 1 0 23 53 1 0 24 54 1 0 25 55 1 0 27 56 1 0 28 57 1 0 30 58 1 0 32 59 1 0 33 60 1 0 36 61 1 0 38 62 1 0 40 63 1 0 42 64 1 0 43 65 1 0 M END