HMDB0030761 RDKit 3D Pterosin O 37 38 0 0 0 0 0 0 0 0999 V2000 4.9305 -0.4755 0.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9196 -0.7862 1.8396 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7109 -0.3395 1.4137 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2094 -0.8874 0.0977 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9116 -0.3025 -0.1708 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8150 0.9843 -0.6322 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9707 1.8055 -0.8854 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4473 1.5433 -0.8814 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5992 0.8066 -0.6659 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5034 -0.4892 -0.2017 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2322 -1.0359 0.0438 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1660 -2.3952 0.5309 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8635 -1.0011 -0.0764 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1667 -2.2115 -0.0621 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7463 0.1975 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1482 -0.1023 -0.4365 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0302 1.1761 -0.8523 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0116 0.6313 0.7864 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9442 -0.7316 1.4071 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7860 -1.0512 0.0252 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9043 -0.5888 2.1762 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6602 0.7780 1.3361 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2173 -1.9929 0.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9849 -0.6638 -0.6592 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0655 2.6634 -0.1554 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9471 1.3472 -0.9593 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8079 2.3220 -1.8807 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5295 2.5593 -1.2461 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0317 -3.0741 -0.3606 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1432 -2.7185 0.9815 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6039 -2.6424 1.2495 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8041 0.5091 1.0802 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7458 0.8162 -0.2667 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5521 -0.8809 0.2426 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1908 -0.4377 -1.4935 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2159 2.2360 -0.5832 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2846 0.9415 -1.9082 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 2 0 6 7 1 0 6 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 10 13 1 0 13 14 2 0 13 15 1 0 15 16 1 0 15 17 1 0 11 5 1 0 17 9 1 0 1 18 1 0 1 19 1 0 1 20 1 0 3 21 1 0 3 22 1 0 4 23 1 0 4 24 1 0 7 25 1 0 7 26 1 0 7 27 1 0 8 28 1 0 12 29 1 0 12 30 1 0 12 31 1 0 15 32 1 0 16 33 1 0 16 34 1 0 16 35 1 0 17 36 1 0 17 37 1 0 M END