Mrv1652309072214282D 14 15 0 0 1 0 999 V2000 1.0396 -1.0396 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7846 -0.2549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0000 0.8250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.6674 1.3099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4211 0.9744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0886 1.4593 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7846 1.0799 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2695 0.4125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.6820 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5070 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9195 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5070 -0.3020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6820 -0.3020 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 1 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 4 8 1 0 0 0 0 9 8 1 1 0 0 0 2 9 1 0 0 0 0 9 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 13 14 1 0 0 0 0 9 14 1 0 0 0 0 M END > NP0249805 > NP-MRD > OCC[C@@H]1CC(=O)[C@@]2(CCCCO2)O1 > InChI=1S/C10H16O4/c11-5-3-8-7-9(12)10(14-8)4-1-2-6-13-10/h8,11H,1-7H2/t8-,10-/m1/s1 > NPTDGRKUWSDIIV-PSASIEDQSA-N > C10H16O4 > 200.234 > 200.104858995 > 4 > 30 > 20.784355151531862 > 1 > 1 > 0 > 1 > (2R,5R)-2-(2-hydroxyethyl)-1,6-dioxaspiro[4.5]decan-4-one > 0.7393774549999995 > 0 > 2 > 0 > 15.968890347855869 > 14.578574014335501 > -2.4097815492153245 > 55.760000000000005 > 49.907700000000006 > 2 > 1 > (2R,5R)-2-(2-hydroxyethyl)-1,6-dioxaspiro[4.5]decan-4-one > 0 > NP0249805 > (2r,5r)-2-(2-hydroxyethyl)-1,6-dioxaspiro[4.5]decan-4-one $$$$