Mrv1652308201916462D 23 25 0 0 0 0 999 V2000 5.0013 2.0625 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 2.8579 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2868 0.0000 0.0000 C 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 0.0000 0.0000 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 4.2868 0.8250 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 0.7145 -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 -0.7145 -1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -1.6500 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 2.1434 -1.2375 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 -1.4289 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4289 -1.6500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -2.4750 0.0000 O 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 2.8579 -1.6500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0013 1.2375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4 2 1 0 0 0 0 5 3 2 0 0 0 0 7 2 2 0 0 0 0 7 3 1 0 0 0 0 8 4 2 0 0 0 0 8 5 1 0 0 0 0 9 6 2 0 0 0 0 10 6 1 0 0 0 0 11 10 2 0 0 0 0 12 9 1 0 0 0 0 13 11 1 0 0 0 0 13 12 2 0 0 0 0 14 11 1 0 0 0 0 15 14 1 0 0 0 0 16 7 1 0 0 0 0 16 15 2 0 0 0 0 17 9 1 0 0 0 0 18 12 1 0 0 0 0 19 13 1 0 0 0 0 20 14 2 0 0 0 0 21 15 1 0 0 0 0 22 1 1 0 0 0 0 22 8 1 0 0 0 0 23 10 1 0 0 0 0 23 16 1 0 0 0 0 M END > NP0052884 > NP-MRD > COC1=CC=C(C=C1)C1=C(O)C(=O)C2=C(O1)C=C(O)C(O)=C2O > InChI=1S/C16H12O7/c1-22-8-4-2-7(3-5-8)16-15(21)14(20)11-10(23-16)6-9(17)12(18)13(11)19/h2-6,17-19,21H,1H3 > CAFWNRISMBVFFM-UHFFFAOYSA-N > C16H12O7 > 316.265 > 316.058302726 > 7 > 35 > 30.690673240075512 > 1 > 4 > 0 > 1 > 3,5,6,7-tetrahydroxy-2-(4-methoxyphenyl)-4H-chromen-4-one > 2.02 > 2.30219352 > -3.36 > 0 > 3 > -1 > 8.097580157264218 > 6.566045937373738 > -3.951706012182762 > 116.45 > 81.34450000000001 > 2 > 1 > 1.38e-01 g/l > 3,5,6,7-tetrahydroxy-2-(4-methoxyphenyl)chromen-4-one > 0 > NP0052884 > 3,5,6,7-Tetrahydroxy-4'-methoxyflavone $$$$