Mrv1533004201506572D 33 36 0 0 0 0 999 V2000 -1.2671 0.6039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4421 0.6039 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0296 -0.1105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7954 -0.1105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2079 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7954 -1.5395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0296 -1.5395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4421 -2.2539 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2671 -2.2539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4421 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2671 -0.8250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0329 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4454 -0.1105 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2704 -0.1105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6829 0.6039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2704 1.3184 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6829 2.0329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5079 0.6039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9204 -0.1105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7454 -0.1105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1579 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7454 -1.5395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1579 -2.2539 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9204 -1.5395 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5079 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6829 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2704 -1.5395 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4454 -1.5395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0329 -2.2539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2079 -2.2539 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7954 -2.9684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2079 -3.6829 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0296 -2.9684 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 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 7 10 2 0 0 0 0 3 10 1 0 0 0 0 10 11 1 0 0 0 0 5 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 15 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 19 25 1 0 0 0 0 25 26 2 0 0 0 0 14 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 12 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 M END > NP0146769 > NP-MRD > COC1=CC(=CC(OC)=C1O)C1OC2=C(OC)C=C3C=CC(=O)OC3=C2OC1COC(C)=O > InChI=1S/C23H22O10/c1-11(24)30-10-17-20(13-8-14(27-2)19(26)15(9-13)28-3)33-22-16(29-4)7-12-5-6-18(25)32-21(12)23(22)31-17/h5-9,17,20,26H,10H2,1-4H3 > SWUVXRNRQZCWMH-UHFFFAOYSA-N > C23H22O10 > 458.419 > 458.121296908 > 8 > 55 > 45.987122067986725 > 1 > 1 > 0 > 1 > [3-(4-hydroxy-3,5-dimethoxyphenyl)-5-methoxy-9-oxo-2H,3H,9H-[1,4]dioxino[2,3-h]chromen-2-yl]methyl acetate > 2.87 > 2.114943677666667 > -3.96 > 1 > 4 > 0 > 9.30018357280165 > -4.253082640969648 > 118.98000000000002 > 113.27329999999999 > 7 > 1 > 5.03e-02 g/l > [3-(4-hydroxy-3,5-dimethoxyphenyl)-5-methoxy-9-oxo-2H,3H-[1,4]dioxino[2,3-h]chromen-2-yl]methyl acetate > 0 > NP0146769 > [3-(4-hydroxy-3,5-dimethoxyphenyl)-5-methoxy-9-oxo-2h,3h-[1,4]dioxino[2,3-h]chromen-2-yl]methyl acetate $$$$