HMDB0035829 RDKit 3D Dihydronepetalactone 28 29 0 0 0 0 0 0 0 0999 V2000 -2.7507 0.7158 0.6933 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7822 0.0516 -0.2243 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6176 -1.3952 0.1864 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6872 -1.9735 -0.7089 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2233 -1.2422 -1.4373 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8393 -1.8015 -2.3811 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5288 0.1869 -1.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8942 0.3748 -0.5462 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5156 -0.9432 -0.1311 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6369 1.2191 0.7076 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2515 0.6828 1.0962 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4727 0.8021 -0.2228 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6609 0.3167 1.7436 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7907 0.5567 0.3547 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5660 1.8243 0.7958 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1794 0.0785 -1.2465 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5959 -1.8946 -0.0116 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3134 -1.4938 1.2477 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4487 0.7783 -2.1264 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5372 0.8858 -1.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4168 -1.1637 -0.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8956 -0.8897 0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8230 -1.8006 -0.2608 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5526 2.2864 0.4081 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3749 1.0253 1.4852 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2000 1.3102 1.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3669 -0.3505 1.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6886 1.8533 -0.4403 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 2 0 5 7 1 0 7 8 1 0 8 9 1 0 8 10 1 0 10 11 1 0 11 12 1 0 12 2 1 0 12 7 1 0 1 13 1 0 1 14 1 0 1 15 1 0 2 16 1 0 3 17 1 0 3 18 1 0 7 19 1 0 8 20 1 0 9 21 1 0 9 22 1 0 9 23 1 0 10 24 1 0 10 25 1 0 11 26 1 0 11 27 1 0 12 28 1 0 M END