HMDB0038386 RDKit 3D Diellagilactone 54 61 0 0 0 0 0 0 0 0999 V2000 -6.2096 -2.4881 1.0332 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1301 -1.9507 0.6743 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0922 -2.6658 0.2417 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9635 -2.1684 -0.1381 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9245 -2.9964 -0.5793 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0779 -4.3754 -0.6210 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7479 -2.3866 -0.9687 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3201 -3.1646 -1.4169 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5669 -1.0045 -0.9369 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6939 -0.4262 -1.3594 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8619 -0.0797 -2.6781 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1396 -0.2665 -3.6187 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0698 0.4804 -3.1123 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1808 0.8126 -4.4671 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1103 0.6956 -2.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2464 1.2245 -2.6521 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2016 1.4070 -1.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3052 1.9139 -2.1491 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1021 1.0833 -0.4393 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0992 1.2708 0.4901 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9597 0.9317 1.8256 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9909 1.1355 2.7404 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7721 0.3783 2.2647 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6118 0.0317 3.5981 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7445 0.1740 1.3588 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5800 -0.3548 1.7251 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6046 -0.5478 0.8608 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5224 -1.0616 1.3060 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7256 -0.2160 -0.4743 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9324 0.3447 -0.9127 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9153 0.5226 0.0356 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6183 -0.2151 -0.4939 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5391 1.1445 -0.4263 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4645 1.6920 -0.7826 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5523 1.8497 -0.0034 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7082 1.3627 0.3872 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7582 2.1318 0.8282 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6182 3.5031 0.8743 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9542 1.5786 1.2287 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0060 2.4016 1.6743 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0890 0.2073 1.1807 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0436 -0.5772 0.7403 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8486 -0.0174 0.3406 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8006 -0.7991 -0.1006 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9607 -4.7579 -0.3235 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2443 -4.1718 -1.4607 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0348 -0.6574 -3.4105 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0528 1.2191 -4.7906 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0302 1.7040 0.1484 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8603 0.8784 3.7079 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7507 -0.3705 3.9211 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7459 3.9169 0.5829 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8596 1.9442 1.9557 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0350 -0.2210 1.4982 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 5 7 1 0 7 8 1 0 7 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 11 13 1 0 13 14 1 0 13 15 2 0 15 16 1 0 16 17 1 0 17 18 2 0 17 19 1 0 19 20 1 0 20 21 2 0 21 22 1 0 21 23 1 0 23 24 1 0 23 25 2 0 25 26 1 0 26 27 1 0 27 28 2 0 27 29 1 0 29 30 2 0 30 31 1 0 9 32 1 0 32 33 1 0 33 34 2 0 33 35 1 0 35 36 1 0 36 37 1 0 37 38 1 0 37 39 2 0 39 40 1 0 39 41 1 0 41 42 2 0 42 43 1 0 43 44 1 0 42 2 1 0 44 4 1 0 29 10 1 0 44 32 2 0 30 15 1 0 43 36 2 0 31 19 2 0 31 25 1 0 6 45 1 0 8 46 1 0 12 47 1 0 14 48 1 0 20 49 1 0 22 50 1 0 24 51 1 0 38 52 1 0 40 53 1 0 41 54 1 0 M END