ChEBI Marvin 10180512072D 19 21 0 0 1 0 999 V2000 14.9999 -6.4848 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 15.6677 -6.0004 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.2541 -7.2696 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 16.3347 -6.4859 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 16.0791 -7.2703 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 16.5635 -7.9382 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.7687 -7.9366 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2154 -6.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6212 -4.1486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6212 -4.9736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9066 -3.7361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9066 -5.3861 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.1922 -4.1486 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.1922 -4.9736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4058 -5.2286 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.8907 -4.5611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4058 -3.8936 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.9066 -2.9111 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.6019 -6.7807 0.0000 * 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 2 4 1 0 0 0 0 3 5 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 6 0 0 0 3 7 1 6 0 0 0 1 8 1 1 0 0 0 19 8 1 0 0 0 0 9 11 1 0 0 0 0 10 12 1 0 0 0 0 11 13 2 0 0 0 0 12 14 2 0 0 0 0 13 14 1 0 0 0 0 16 15 1 0 0 0 0 10 15 1 0 0 0 0 17 16 2 0 0 0 0 9 10 2 0 0 0 0 9 17 1 0 0 0 0 18 11 1 0 0 0 0 4 15 1 1 0 0 0 M END > CHEBI:22261 > 5'-adenosyl group > 3 > adenosyl group > 1-(adenin-9-yl)-1,5-dideoxy-beta-D-ribofuranos-5-yl > C10H12N5O3 > 250.23418 > 250.09401 > 0 > [C@@H]1(O[C@H]([C@@H]([C@@H]1O)O)N2C=NC=3C(=NC=NC23)N)C* $$$$