HMDB0038273 RDKit 3D 2-Hexenyl valerate 33 32 0 0 0 0 0 0 0 0999 V2000 6.4518 0.2624 -0.5221 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1794 -0.2854 0.0727 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9694 0.5525 -0.3625 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7867 -0.0665 0.2713 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8053 -0.5305 -0.4605 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6273 -1.1480 0.1944 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5088 -0.3850 -0.1902 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7887 -0.6838 0.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9270 -1.6696 1.0031 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9894 0.0900 -0.1391 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1922 -0.5137 0.5096 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4794 0.1897 0.1934 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5017 1.6180 0.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5398 -0.1761 -1.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2977 -0.1267 0.0827 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4329 1.3614 -0.5956 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1883 -0.2752 1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9701 -1.3197 -0.2388 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0606 1.5980 0.0299 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8749 0.5484 -1.4681 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7462 -0.1290 1.3408 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8252 -0.4781 -1.5359 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5397 -2.2045 -0.1273 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7565 -1.1639 1.2983 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0501 0.0211 -1.2652 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8265 1.1552 0.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2278 -1.5835 0.2267 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9859 -0.5174 1.6196 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2970 -0.3550 0.7061 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6193 0.1503 -0.9011 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5574 2.1558 0.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8390 1.7120 1.6906 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2613 2.1968 0.0348 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 2 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 2 0 8 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 1 14 1 0 1 15 1 0 1 16 1 0 2 17 1 0 2 18 1 0 3 19 1 0 3 20 1 0 4 21 1 0 5 22 1 0 6 23 1 0 6 24 1 0 10 25 1 0 10 26 1 0 11 27 1 0 11 28 1 0 12 29 1 0 12 30 1 0 13 31 1 0 13 32 1 0 13 33 1 0 M END