Mrv1652309082205292D 14 14 0 0 0 0 999 V2000 0.0000 3.3000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 2.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 2.0625 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 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1434 1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8579 0.8250 0.0000 O 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 2.8579 -0.0000 0.0000 C 0 0 0 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 0.0000 0.0000 0.0000 C 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 0.8250 0.0000 O 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 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 5 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 8 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 4 14 1 0 0 0 0 M END > NP0261132 > NP-MRD > CCCC1=C(CO)C(OC)=CC(O)O1 > InChI=1S/C10H16O4/c1-3-4-8-7(6-11)9(13-2)5-10(12)14-8/h5,10-12H,3-4,6H2,1-2H3 > PNESTIDLKFVVIG-UHFFFAOYSA-N > C10H16O4 > 200.234 > 200.104858995 > 4 > 30 > 21.104212008903822 > 1 > 2 > 0 > 1 > 5-(hydroxymethyl)-4-methoxy-6-propyl-2H-pyran-2-ol > -0.13934248466666666 > 0 > 1 > 0 > 14.942475838524413 > 11.914319869763563 > -2.8264728623624045 > 58.92 > 54.88440000000001 > 4 > 1 > 5-(hydroxymethyl)-4-methoxy-6-propyl-2H-pyran-2-ol > 0 > NP0261132 > 5-(hydroxymethyl)-4-methoxy-6-propyl-2h-pyran-2-ol $$$$