Mrv1652309072208082D 14 15 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 1.4289 -1.6500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7145 -1.2375 0.0000 O 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 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 C 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 3.5724 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2868 -0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5724 -1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8579 -1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8579 -2.4750 0.0000 O 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 1 1 1 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 2 0 0 0 0 7 14 1 0 0 0 0 2 14 1 0 0 0 0 M END > NP0245159 > NP-MRD > C[C@H]1OC(=O)CC2=CC(O)=CC(O)=C12 > InChI=1S/C10H10O4/c1-5-10-6(3-9(13)14-5)2-7(11)4-8(10)12/h2,4-5,11-12H,3H2,1H3/t5-/m1/s1 > AIJQFRIMFUSUEZ-RXMQYKEDSA-N > C10H10O4 > 194.186 > 194.057908802 > 3 > 24 > 18.797507900631267 > 1 > 2 > 0 > 1 > (1R)-6,8-dihydroxy-1-methyl-3,4-dihydro-1H-2-benzopyran-3-one > 1.3175598439999998 > 0 > 2 > 0 > 10.408255772740766 > 8.868623341303083 > -5.675334932888128 > 66.76 > 49.069900000000004 > 0 > 1 > (1R)-6,8-dihydroxy-1-methyl-1,4-dihydro-2-benzopyran-3-one > 0 > NP0245159 > (1r)-6,8-dihydroxy-1-methyl-1,4-dihydro-2-benzopyran-3-one $$$$