HMDB0246976 RDKit 3D 7-[(1S,2S,3R,4R)-3-[(3S)-3-Hydroxyoct-1-enyl]-5-oxabicyclo[2.2.1]heptan-2-yl]... 59 60 0 0 0 0 0 0 0 0999 V2000 -8.4614 -0.7103 0.6759 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9318 -0.6150 0.6818 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5364 -0.1082 -0.6741 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0353 0.0424 -0.8305 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5355 1.0197 0.1983 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9929 1.1677 0.0286 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5876 2.0916 0.9804 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3892 -0.1521 0.1333 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2383 -0.6538 -0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0059 -0.0837 -0.6722 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0851 1.4013 -0.7578 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 1.7770 0.6242 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8561 0.8835 0.4875 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3371 1.3844 -0.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2110 1.6813 -1.5789 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1306 -0.4058 0.3413 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9798 -1.5529 -0.1769 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0531 -1.8723 0.7728 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3290 -1.8313 0.4841 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8824 -1.4695 -0.8071 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7891 -0.2555 -0.7661 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9757 -0.5002 0.1614 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8501 0.7002 0.1868 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5511 1.7134 -0.5004 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9862 0.6877 0.9693 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.7922 -1.0682 -0.3259 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8268 -1.4028 1.4347 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8256 0.3413 0.8173 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4682 -1.5943 0.8814 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6567 0.0704 1.5042 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9234 -0.8110 -1.4292 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0169 0.8726 -0.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8955 0.5554 -1.8275 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5106 -0.9093 -0.8091 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0083 2.0085 0.0293 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7490 0.7345 1.2336 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9304 1.5339 -1.0204 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1594 2.0530 1.8046 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1138 -0.9206 0.5812 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1722 -1.7785 0.0971 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2796 -0.5709 -1.6544 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7738 1.9580 -1.0751 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8480 2.8196 0.7368 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0749 1.3431 1.3767 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5098 0.9864 1.3314 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8756 2.3756 -0.7175 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0380 0.7155 -1.3572 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6967 -0.6904 1.3144 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3414 -2.4718 -0.2625 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3154 -1.2464 -1.1688 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7204 -2.1642 1.7959 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0076 -2.0980 1.3074 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1785 -1.3463 -1.6217 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5899 -2.3212 -1.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2132 -0.1399 -1.7847 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2759 0.6804 -0.5164 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5909 -0.6828 1.1915 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5761 -1.3386 -0.2271 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9494 0.1667 1.8448 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 6 8 1 0 8 9 2 3 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 13 16 1 0 16 17 1 0 17 18 1 0 18 19 2 3 19 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 2 0 23 25 1 0 16 10 1 0 15 11 1 0 1 26 1 0 1 27 1 0 1 28 1 0 2 29 1 0 2 30 1 0 3 31 1 0 3 32 1 0 4 33 1 0 4 34 1 0 5 35 1 0 5 36 1 0 6 37 1 0 7 38 1 0 8 39 1 0 9 40 1 0 10 41 1 0 11 42 1 0 12 43 1 0 12 44 1 0 13 45 1 0 14 46 1 0 14 47 1 0 16 48 1 0 17 49 1 0 17 50 1 0 18 51 1 0 19 52 1 0 20 53 1 0 20 54 1 0 21 55 1 0 21 56 1 0 22 57 1 0 22 58 1 0 25 59 1 0 M END