68614 -OEChem-10051723593D 23 22 0 1 0 0 0 0 0999 V2000 -2.0594 1.3710 0.0599 F -1 0 0 0 0 0 0 0 0 0 0 0 0.4373 1.6493 -0.2054 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7248 -0.7351 -1.2439 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1072 -1.5249 0.5780 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2942 -0.0832 -0.3928 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0500 -0.3349 -0.4079 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6242 0.3811 0.4194 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.6261 -0.4783 0.1565 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9208 -0.2767 -0.0929 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.9363 0.1453 0.6488 C 0 0 2 0 0 0 0 0 0 0 0 0 3.1581 0.5873 0.1443 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1452 -0.7008 0.3359 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6954 0.5465 1.5021 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4986 -1.4517 0.6459 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8508 -0.4924 -1.1651 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9058 0.3058 1.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0757 1.5581 -0.3521 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3339 0.7378 1.2144 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0747 2.2695 0.1866 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3986 -1.4230 -1.3762 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1756 -1.3435 1.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1778 -1.6882 0.8272 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0657 0.4844 -0.2244 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 2 7 1 0 0 0 0 2 19 1 0 0 0 0 3 8 1 0 0 0 0 3 20 1 0 0 0 0 4 9 1 0 0 0 0 4 21 1 0 0 0 0 5 11 1 0 0 0 0 5 23 1 0 0 0 0 6 12 2 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 13 1 0 0 0 0 8 10 1 0 0 0 0 8 14 1 0 0 0 0 9 11 1 0 0 0 0 9 15 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 11 17 1 0 0 0 0 11 18 1 0 0 0 0 12 22 1 0 0 0 0 M ISO 1 1 18 M END > DB09502 > drugbank > PUBCHEM > https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/inchikey/AOYNUTHNTBLRMT-MXWOLSILSA-N/SDF?record_type=3d > [H]C(=O)[C@H]([18F])[C@@H](O)[C@H](O)[C@H](O)CO > InChI=1S/C6H11FO5/c7-3(1-8)5(11)6(12)4(10)2-9/h1,3-6,9-12H,2H2/t3-,4+,5+,6+/m0/s1/i7-1 > AOYNUTHNTBLRMT-MXWOLSILSA-N > C6H11FO5 > 181.15 > 181.061586121 > 5 > 23 > 15.53708929322334 > 1 > 4 > 0 > 0 > (2R,3S,4R,5R)-2-(¹⁸F)fluoro-3,4,5,6-tetrahydroxyhexanal > -1.84 > -2.6772687889999998 > -0.12 > 0 > 0 > 0 > 12.464156964478391 > 10.318442418429404 > -2.9742258034472613 > 97.99000000000001 > 35.6535 > 5 > 1 > 1.39e+02 g/l > (2R,3S,4R,5R)-2-(¹⁸F)fluoro-3,4,5,6-tetrahydroxyhexanal > 0 $$$$