HMDB0038887 RDKit 3D Glucoemodin 51 54 0 0 0 0 0 0 0 0999 V2000 7.9995 0.1434 2.0655 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7821 -0.2050 1.2799 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8622 -0.9997 0.1634 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7299 -1.3468 -0.6002 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9361 -2.1331 -1.6747 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5034 -0.8732 -0.2137 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3748 -0.0638 0.9123 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5291 0.2428 1.6232 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0771 0.4380 1.3221 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9431 1.1670 2.3318 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8684 0.0974 0.5496 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6417 0.5726 0.9383 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5103 0.2493 0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7140 0.7616 0.6512 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9334 0.5487 0.0586 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8017 -0.0414 0.9846 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9912 -0.4417 0.4446 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1699 -0.1657 1.3886 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9326 -0.8806 2.5767 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2907 0.0744 -0.9138 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8576 -0.8565 -1.8797 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7933 1.4519 -1.1957 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8062 2.4069 -1.2118 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6417 1.8703 -0.3051 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1522 2.4958 0.8064 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3530 -0.5482 -0.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8828 -1.0548 -1.3296 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8816 -1.8332 -2.4418 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9903 -0.7071 -0.5708 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3030 -1.2158 -0.9871 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3750 -1.9297 -1.9899 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7881 -0.6278 1.9535 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3353 1.1514 1.7371 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7106 0.2439 3.1403 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8384 -1.3690 -0.1332 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4190 -2.5444 -2.3846 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4004 0.8680 2.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5911 1.1919 1.8111 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9222 -0.0739 -0.8282 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9566 -1.5699 0.3739 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1023 -0.5934 0.9677 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2806 0.9102 1.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2164 -0.3620 3.3616 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4130 0.1027 -1.0235 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1734 -1.7393 -1.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3690 1.4369 -2.2431 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8756 2.8867 -2.0753 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9508 2.5612 -0.8096 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8225 3.4340 0.8957 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2292 -0.8128 -1.4833 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4963 -2.3180 -2.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 1 0 4 6 2 0 6 7 1 0 7 8 2 0 7 9 1 0 9 10 2 0 9 11 1 0 11 12 2 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 17 20 1 0 20 21 1 0 20 22 1 0 22 23 1 0 22 24 1 0 24 25 1 0 13 26 2 0 26 27 1 0 27 28 1 0 27 29 2 0 29 30 1 0 30 31 2 0 8 2 1 0 29 11 1 0 30 6 1 0 24 15 1 0 1 32 1 0 1 33 1 0 1 34 1 0 3 35 1 0 5 36 1 0 8 37 1 0 12 38 1 0 15 39 1 0 17 40 1 0 18 41 1 0 18 42 1 0 19 43 1 0 20 44 1 0 21 45 1 0 22 46 1 0 23 47 1 0 24 48 1 0 25 49 1 0 26 50 1 0 28 51 1 0 M END