HMDB0061942 RDKit 3D cis-3-Hexenyl salicylate 32 32 0 0 0 0 0 0 0 0999 V2000 -5.1244 -1.7327 -0.7164 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0859 -0.6966 -1.1659 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7798 -1.2998 -1.0391 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8413 -0.8171 -0.2651 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0197 0.3742 0.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9719 1.4081 0.1005 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3080 0.8428 0.3296 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4756 1.4859 0.0323 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3943 2.6404 -0.4761 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7897 0.9206 0.2659 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9184 1.6786 -0.0984 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1885 1.2079 0.0802 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3983 -0.0442 0.6319 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3318 -0.8160 1.0011 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0336 -0.3010 0.8038 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0222 -1.1330 1.2006 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0683 -1.2576 -0.4434 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2073 -2.5111 -1.5005 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6888 -2.2527 0.1825 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3018 -0.6006 -2.2831 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2794 0.2803 -0.7676 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5449 -2.2174 -1.6201 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8446 -1.3085 -0.1932 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7397 0.1906 1.6354 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9596 0.9024 0.5081 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1107 2.3698 0.6468 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1142 1.5210 -0.9877 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7861 2.6748 -0.5382 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0779 1.7623 -0.1878 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4115 -0.4294 0.7785 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4917 -1.7922 1.4314 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0549 -1.0496 1.1950 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 2 0 8 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 15 16 1 0 15 10 1 0 1 17 1 0 1 18 1 0 1 19 1 0 2 20 1 0 2 21 1 0 3 22 1 0 4 23 1 0 5 24 1 0 5 25 1 0 6 26 1 0 6 27 1 0 11 28 1 0 12 29 1 0 13 30 1 0 14 31 1 0 16 32 1 0 M END