KEGG:C03003 N-Glucosylnicotinate ISISHOST03240423072D 1 1.00000 0.00000 2651 20 21 0 1 0 999 V2000 -0.0310 -0.5207 0.0000 C 0 0 2 0 0 0 0 0 0 0.7241 0.2241 0.0000 N 0 3 0 0 0 0 0 0 0 -0.7379 -0.1138 0.0000 O 0 0 0 0 0 0 0 0 0 -0.0310 -1.3379 0.0000 C 0 0 1 0 0 0 0 0 0 1.4552 0.6759 0.0000 C 0 0 0 0 0 0 0 0 0 0.0241 0.6310 0.0000 C 0 0 0 0 0 0 0 0 0 -1.4448 -0.5207 0.0000 C 0 0 1 0 0 0 0 0 0 -0.7379 -1.7379 0.0000 C 0 0 2 0 0 0 0 0 0 0.6724 -1.7379 0.0000 O 0 0 0 0 0 0 0 0 0 1.4448 1.4517 0.0000 C 0 0 0 0 0 0 0 0 0 0.0172 1.4483 0.0000 C 0 0 0 0 0 0 0 0 0 -1.4448 -1.3379 0.0000 C 0 0 2 0 0 0 0 0 0 -2.1379 -0.1138 0.0000 C 0 0 0 0 0 0 0 0 0 -0.7379 -2.5483 0.0000 O 0 0 0 0 0 0 0 0 0 0.7276 1.8586 0.0000 C 0 0 0 0 0 0 0 0 0 2.1379 1.8690 0.0000 C 0 0 0 0 0 0 0 0 0 -2.1379 -1.7379 0.0000 O 0 0 0 0 0 0 0 0 0 -2.7621 -0.6379 0.0000 O 0 0 0 0 0 0 0 0 0 2.8448 1.4621 0.0000 O 0 0 0 0 0 0 0 0 0 2.1552 2.7241 0.0000 O 0 0 0 0 0 0 0 0 0 1 2 1 1 0 0 1 3 1 0 0 0 1 4 1 0 0 0 2 5 1 0 0 0 2 6 2 0 0 0 3 7 1 0 0 0 4 8 1 0 0 0 4 9 1 6 0 0 5 10 2 0 0 0 6 11 1 0 0 0 7 12 1 0 0 0 7 13 1 1 0 0 8 14 1 1 0 0 10 15 1 0 0 0 10 16 1 0 0 0 12 17 1 6 0 0 13 18 1 0 0 0 16 19 1 0 0 0 16 20 2 0 0 0 8 12 1 0 0 0 11 15 2 0 0 0 M CHG 1 2 1 M END