HMDB0041091 RDKit 3D 1-(4-Hydroxy-3,5-dimethoxyphenyl)-7-(4-hydroxy-3-methoxyphenyl)-3,5-heptanediol 59 60 0 0 0 0 0 0 0 0999 V2000 5.3014 2.4945 2.6226 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1168 2.4945 1.4712 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8384 1.5769 0.4662 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7953 0.6754 0.5655 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5056 -0.2397 -0.4195 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3450 -1.1927 -0.2324 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1235 -0.5456 -0.7905 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9224 -1.4385 -0.6563 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1638 -2.6295 -1.3496 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6057 -1.6784 0.7947 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6090 -2.5727 0.9667 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2890 -3.7850 0.3362 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8598 -1.9699 0.3694 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1539 -0.6581 1.0369 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3800 -0.0099 0.4957 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3305 0.8616 -0.5729 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4867 1.4643 -1.0726 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4475 2.3458 -2.1512 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2905 2.7155 -2.8324 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7196 1.2065 -0.5118 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8744 1.8137 -1.0174 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7652 0.3355 0.5552 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0213 0.0813 1.1164 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0870 -0.8137 2.2165 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6185 -0.2619 1.0506 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2637 -0.2857 -1.5599 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3193 0.5979 -1.7042 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5923 1.5150 -0.6924 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6553 2.3654 -0.8978 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5562 3.3933 3.2477 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2306 2.6148 2.2966 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3575 1.5654 3.2063 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1741 0.6811 1.4513 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5544 -2.1692 -0.6985 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2218 -1.3691 0.8743 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9137 0.3646 -0.1771 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2710 -0.1739 -1.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0690 -0.9628 -1.1908 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7467 -3.2363 -0.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4738 -2.2590 1.2238 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5475 -0.7381 1.3423 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7558 -2.7488 2.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8459 -4.4764 0.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6909 -1.8585 -0.7208 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7066 -2.6823 0.4613 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2735 0.0125 0.8449 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1973 -0.8107 2.1322 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3758 1.0761 -1.0252 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7348 3.4770 -2.2419 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6502 1.8035 -2.9338 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5916 3.1215 -3.8219 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7873 2.4446 -1.8012 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6036 -1.7572 1.8765 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5614 -0.3815 3.1008 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1417 -1.0574 2.4576 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6719 -0.9406 1.8856 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0491 -1.0014 -2.3472 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9204 0.5697 -2.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8872 3.0365 -0.2028 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 1 0 6 7 1 0 7 8 1 0 8 9 1 0 8 10 1 0 10 11 1 0 11 12 1 0 11 13 1 0 13 14 1 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 1 0 18 19 1 0 17 20 2 0 20 21 1 0 20 22 1 0 22 23 1 0 23 24 1 0 22 25 2 0 5 26 2 0 26 27 1 0 27 28 2 0 28 29 1 0 28 3 1 0 25 15 1 0 1 30 1 0 1 31 1 0 1 32 1 0 4 33 1 0 6 34 1 0 6 35 1 0 7 36 1 0 7 37 1 0 8 38 1 0 9 39 1 0 10 40 1 0 10 41 1 0 11 42 1 0 12 43 1 0 13 44 1 0 13 45 1 0 14 46 1 0 14 47 1 0 16 48 1 0 19 49 1 0 19 50 1 0 19 51 1 0 21 52 1 0 24 53 1 0 24 54 1 0 24 55 1 0 25 56 1 0 26 57 1 0 27 58 1 0 29 59 1 0 M END