HMDB0037632 RDKit 3D xi-Tetrahydro-3-pentyl-2H-pyran-2-one 30 30 0 0 0 0 0 0 0 0999 V2000 4.8295 0.1162 -0.5117 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5307 -0.2992 0.1047 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3312 0.2164 -0.6883 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0987 -0.2811 0.0533 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1676 0.1479 -0.6096 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4086 -0.3084 0.0674 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6180 0.2051 -0.7295 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8233 0.3840 0.1398 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8560 -0.5771 1.3227 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7117 -0.2315 2.1223 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6038 0.2478 1.4309 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8151 1.0946 1.9178 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0503 -0.5411 -1.3618 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6271 -0.0579 0.2444 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8631 1.1947 -0.7683 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 0.0199 1.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4739 -1.4232 0.0275 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3648 -0.1025 -1.7309 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4049 1.3162 -0.6659 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1475 0.1910 1.0559 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1112 -1.3694 0.1332 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1820 -0.2192 -1.6554 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2375 1.2715 -0.7012 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4620 -1.4149 0.1716 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3029 1.2241 -1.0916 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7971 -0.4035 -1.6285 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8988 1.4093 0.5648 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7635 0.2413 -0.4628 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7954 -0.4175 1.8573 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7924 -1.6332 0.9876 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 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 2 0 11 6 1 0 1 13 1 0 1 14 1 0 1 15 1 0 2 16 1 0 2 17 1 0 3 18 1 0 3 19 1 0 4 20 1 0 4 21 1 0 5 22 1 0 5 23 1 0 6 24 1 0 7 25 1 0 7 26 1 0 8 27 1 0 8 28 1 0 9 29 1 0 9 30 1 0 M END