Mrv1652309042221402D 14 14 0 0 1 0 999 V2000 1.4289 2.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 2.0625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1434 -0.4125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -0.4125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 0.0000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7145 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 -1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4289 -1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4289 -2.4750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1434 -1.2375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 0.8250 0.0000 C 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 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 6 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 8 14 1 0 0 0 0 3 14 1 0 0 0 0 M END > NP0200763 > NP-MRD > COC1=CC(=O)O[C@H](CCC(O)=O)C1 > InChI=1S/C9H12O5/c1-13-7-4-6(2-3-8(10)11)14-9(12)5-7/h5-6H,2-4H2,1H3,(H,10,11)/t6-/m1/s1 > RFSJIFOJAVZVDT-ZCFIWIBFSA-N > C9H12O5 > 200.19 > 200.068473486 > 4 > 26 > 18.9967004360387 > 1 > 1 > 0 > 1 > 3-[(2R)-4-methoxy-6-oxo-3,6-dihydro-2H-pyran-2-yl]propanoic acid > 0.10198013766666687 > 0 > 1 > -1 > 16.48885128897545 > 4.128950428931789 > -4.787811526469697 > 72.83 > 47.96550000000001 > 4 > 1 > 3-[(2R)-4-methoxy-6-oxo-2,3-dihydropyran-2-yl]propanoic acid > 0 > NP0200763 > 3-[(2r)-4-methoxy-6-oxo-2,3-dihydropyran-2-yl]propanoic acid $$$$