HMDB0036824 RDKit 3D Acetal R 35 35 0 0 0 0 0 0 0 0999 V2000 5.2347 0.0790 0.4664 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0811 -0.6656 1.0961 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9409 -0.8460 0.0854 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5227 0.4375 -0.3147 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4833 0.3527 -1.2376 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9691 1.0183 -2.5085 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4064 1.0475 -0.7032 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7074 0.2615 -0.4897 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7907 1.1237 0.0847 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0463 0.3725 0.3559 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0066 0.2812 -0.6309 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1996 -0.3930 -0.4711 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4224 -0.9999 0.7476 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4832 -0.9314 1.7638 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2981 -0.2431 1.5591 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0398 1.1730 0.6075 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3002 -0.1791 -0.6165 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1530 -0.1976 1.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4430 -1.6546 1.4424 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6985 -0.0580 1.9391 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2947 -1.3916 -0.8082 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0936 -1.3500 0.5631 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2708 -0.7136 -1.4034 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1627 1.1774 -3.2451 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7579 0.4135 -2.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3818 2.0003 -2.2418 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0323 -0.2892 -1.3939 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4338 -0.4917 0.2809 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4275 1.4863 1.0797 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0612 1.9697 -0.5805 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7948 0.7780 -1.5911 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9469 -0.4523 -1.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3568 -1.5286 0.8743 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6761 -1.4134 2.7114 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5502 -0.1735 2.3315 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 5 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 15 10 1 0 1 16 1 0 1 17 1 0 1 18 1 0 2 19 1 0 2 20 1 0 3 21 1 0 3 22 1 0 5 23 1 0 6 24 1 0 6 25 1 0 6 26 1 0 8 27 1 0 8 28 1 0 9 29 1 0 9 30 1 0 11 31 1 0 12 32 1 0 13 33 1 0 14 34 1 0 15 35 1 0 M END