HMDB0030802 RDKit 3D Patuletin 36 38 0 0 0 0 0 0 0 0999 V2000 5.9820 -0.1276 -0.6198 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1262 -0.8357 0.2567 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7416 -0.8066 0.1256 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1200 -1.7337 -0.6515 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8373 -2.7342 -1.3363 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7532 -1.6529 -0.7411 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0372 -0.6704 -0.0699 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2524 -0.6014 -0.1607 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0352 0.2882 0.4332 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4765 0.1986 0.2056 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9918 -1.0645 -0.1698 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3130 -1.2342 -0.4746 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2033 -0.1760 -0.4287 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5486 -0.3176 -0.7311 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7436 1.0657 -0.0706 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5637 2.1758 0.0005 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3939 1.1992 0.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4846 1.2405 1.2288 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1010 2.2111 1.9283 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9332 1.2341 1.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4498 2.1084 2.1046 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6545 0.2817 0.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0367 0.2046 0.8201 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7469 1.0870 1.5728 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8731 -0.7591 -0.8273 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4982 0.1856 -1.5426 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3803 0.7922 -0.1014 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3541 -3.4127 -1.9083 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2508 -2.3959 -1.3644 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2966 -1.9033 -0.2083 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6907 -2.2135 -0.7608 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9383 -1.2112 -1.0007 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1838 3.0701 0.2684 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0652 2.1982 0.4488 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9753 2.4865 2.1163 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4823 1.8228 2.1055 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 4 6 1 0 6 7 2 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 13 15 1 0 15 16 1 0 15 17 2 0 9 18 2 0 18 19 1 0 18 20 1 0 20 21 2 0 20 22 1 0 22 23 2 0 23 24 1 0 23 3 1 0 22 7 1 0 17 10 1 0 1 25 1 0 1 26 1 0 1 27 1 0 5 28 1 0 6 29 1 0 11 30 1 0 12 31 1 0 14 32 1 0 16 33 1 0 17 34 1 0 19 35 1 0 24 36 1 0 M END