HMDB0038291 RDKit 3D 2-Propenyl cyclohexanebutanoate 37 37 0 0 0 0 0 0 0 0999 V2000 6.7004 0.4016 0.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5583 -0.1353 0.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2941 0.6436 0.6003 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3517 0.0051 -0.2739 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1040 0.5067 -0.5156 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7847 1.5740 0.0609 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1081 -0.1288 -1.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1786 0.5717 -1.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9809 0.7437 -0.2915 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4164 -0.4998 0.4152 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2247 -0.0884 1.6267 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5580 0.4899 1.3067 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3579 -0.5529 0.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6286 -0.9025 -0.6887 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2338 -1.4199 -0.4457 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6024 -0.1740 0.3431 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7295 1.4138 -0.0568 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5171 -1.1575 1.0162 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8115 0.6608 1.5992 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4739 1.6946 0.3126 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6129 -0.1568 -2.4251 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0610 -1.1922 -1.1121 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0037 1.5632 -1.9992 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8088 0.0193 -2.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4765 1.3946 0.4489 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9385 1.3071 -0.5158 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5546 -1.0702 0.8535 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3708 -1.0224 2.2268 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6307 0.6573 2.2288 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0819 0.6593 2.2731 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5028 1.4464 0.7802 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5246 -1.4016 1.2303 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3223 -0.0862 0.2756 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1872 -1.7490 -1.1862 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6211 -0.0216 -1.3662 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7899 -1.6052 -1.4348 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3243 -2.3883 0.0617 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 3 2 3 1 0 3 4 1 0 4 5 1 0 5 6 2 0 5 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 10 1 0 1 16 1 0 1 17 1 0 2 18 1 0 3 19 1 0 3 20 1 0 7 21 1 0 7 22 1 0 8 23 1 0 8 24 1 0 9 25 1 0 9 26 1 0 10 27 1 0 11 28 1 0 11 29 1 0 12 30 1 0 12 31 1 0 13 32 1 0 13 33 1 0 14 34 1 0 14 35 1 0 15 36 1 0 15 37 1 0 M END