HMDB0252536 RDKit 3D Furagin 27 28 0 0 0 0 0 0 0 0999 V2000 -3.0456 2.0343 2.3850 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1925 0.9183 1.7928 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8763 0.6691 0.4893 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0436 -0.4033 -0.0588 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7081 -0.5999 -1.4016 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4905 -0.5646 -1.8168 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3770 -0.3168 -0.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8730 -0.2824 -1.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0001 -0.0374 -0.4718 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9348 0.1859 0.8912 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2330 0.3688 1.3136 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0301 0.2505 0.1994 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4425 0.3631 0.1443 N 0 0 0 0 0 4 0 0 0 0 0 0 6.1322 0.5925 1.1554 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1012 0.2192 -1.0508 O 0 0 0 0 0 1 0 0 0 0 0 0 3.2474 0.0114 -0.8219 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6497 -1.2020 1.0688 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2927 -2.4081 1.0137 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7472 -0.3655 2.2170 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8833 0.2001 0.6441 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9197 1.5462 -0.1527 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2863 -0.7215 -2.8562 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6184 -0.1609 0.1383 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0475 -0.4434 -2.3992 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0451 0.2091 1.4869 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5766 0.5664 2.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5325 -0.6290 3.2148 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 2 3 6 7 1 0 7 8 2 3 8 9 1 0 9 10 2 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 13 15 1 0 12 16 1 0 4 17 1 0 17 18 2 0 17 19 1 0 19 2 1 0 16 9 1 0 3 20 1 0 3 21 1 0 6 22 1 0 7 23 1 0 8 24 1 0 10 25 1 0 11 26 1 0 19 27 1 0 M CHG 2 13 1 15 -1 M END