HMDB0029523 RDKit 3D Neohesperidose 44 45 0 0 0 0 0 0 0 0999 V2000 -3.6305 -0.9967 2.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0626 -0.3599 0.9575 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9384 0.4042 1.2729 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1914 0.6399 0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3150 -0.4284 -0.0068 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0088 -0.0842 0.1366 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6767 -0.7517 1.3111 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8552 -0.5635 2.4187 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9119 -0.1269 1.4963 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7349 -0.4644 0.4182 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1758 -0.0863 0.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6616 -0.7349 1.8037 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2119 0.2712 -0.7853 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0502 0.2220 -1.8760 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8359 -0.3328 -1.0966 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3368 0.2699 -2.2282 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9709 0.7949 -1.1176 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7920 -0.3276 -1.9521 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4241 1.0457 -0.9798 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7353 2.4020 -1.1987 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0261 0.6519 0.3252 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2871 0.0837 0.1681 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3309 -2.0829 2.1556 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1717 -0.5721 3.0857 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7321 -0.9877 2.2177 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7559 -1.0986 0.1901 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5872 1.5524 0.3319 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0398 1.0136 0.3355 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8941 -1.8254 1.1368 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1889 0.1476 3.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6581 -1.5471 0.1986 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7553 -0.3562 -0.2222 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2553 1.0160 0.7865 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9727 -1.3666 2.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0271 1.3296 -0.4784 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2451 -0.6944 -2.1293 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0110 -1.4345 -1.2389 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2628 -0.4089 -2.9496 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5350 1.6476 -1.7199 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9016 -0.0912 -2.9043 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0017 0.4975 -1.7829 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0335 2.8267 -0.3742 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0995 1.5466 0.9753 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2472 -0.6404 -0.5056 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 7 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 10 13 1 0 13 14 1 0 13 15 1 0 15 16 1 0 4 17 1 0 17 18 1 0 17 19 1 0 19 20 1 0 19 21 1 0 21 22 1 0 21 2 1 0 15 6 1 0 1 23 1 0 1 24 1 0 1 25 1 0 2 26 1 0 4 27 1 0 6 28 1 0 7 29 1 0 8 30 1 0 10 31 1 0 11 32 1 0 11 33 1 0 12 34 1 0 13 35 1 0 14 36 1 0 15 37 1 0 16 38 1 0 17 39 1 0 18 40 1 0 19 41 1 0 20 42 1 0 21 43 1 0 22 44 1 0 M END