HMDB6603.mol Mrv0541 02231220452D 24 24 0 0 0 0 999 V2000 -1.7862 -0.5156 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.7862 -1.3406 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.0717 -1.7531 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.3572 -1.3406 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.3572 -0.5156 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0717 -0.1031 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.0717 0.7219 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3572 1.1344 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.3572 1.9594 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.3572 0.7219 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.0717 1.1344 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7862 0.7219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5006 1.1344 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3572 2.3719 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0717 1.9594 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5006 -1.7531 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0717 -2.5781 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3572 -1.7531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0717 -1.3406 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5006 -0.1031 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3572 -0.1031 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0717 1.5469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7158 2.5781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1295 3.2918 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 6 7 1 6 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 9 14 1 6 0 0 0 11 15 1 6 0 0 0 2 16 1 6 0 0 0 3 17 1 6 0 0 0 4 18 1 6 0 0 0 18 19 1 0 0 0 0 1 20 1 1 0 0 0 10 21 1 1 0 0 0 8 22 1 1 0 0 0 9 23 1 0 0 0 0 23 24 2 0 0 0 0 M STY 1 1 SUP M SAL 1 2 23 24 M SBL 1 1 23 M SMT 1 CHO M END