Mrv1533004201506352D 31 32 0 0 0 0 999 V2000 2.4034 -4.2277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5909 -4.3710 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0606 -3.7390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2481 -3.8822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2822 -3.2502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0946 -3.3935 0.0000 O 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 -0.8125 -2.3317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3428 -2.9637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1552 -2.8205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8125 -2.3317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3428 -2.9637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1552 -2.8205 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6855 -3.4525 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 -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 1.4289 -1.6500 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 2.8579 -1.6500 0.0000 O 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 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 0.0000 0.8250 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 2.0625 0.0000 O 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 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 O 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 1.4289 0.0000 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 0 0 0 0 9 10 2 0 0 0 0 7 11 1 0 0 0 0 11 12 2 0 0 0 0 3 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 7 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 17 22 1 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 25 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 28 31 2 0 0 0 0 22 31 1 0 0 0 0 M END > NP0170390 > NP-MRD > COC1=CC=C(C=C1OC)C(OC(C)=O)C(C)C1(CC=C)C=C(OC)C(OC)=CC1=O > InChI=1S/C24H30O7/c1-8-11-24(14-21(30-7)20(29-6)13-22(24)26)15(2)23(31-16(3)25)17-9-10-18(27-4)19(12-17)28-5/h8-10,12-15,23H,1,11H2,2-7H3 > SVCDSCSVRZHKRQ-UHFFFAOYSA-N > C24H30O7 > 430.497 > 430.199153306 > 6 > 61 > 44.76954464983358 > 1 > 0 > 0 > 1 > 2-[3,4-dimethoxy-6-oxo-1-(prop-2-en-1-yl)cyclohexa-2,4-dien-1-yl]-1-(3,4-dimethoxyphenyl)propyl acetate > 3.80 > 2.975092943333334 > -5.11 > 0 > 2 > 0 > -4.275134028993753 > 80.29 > 119.42789999999998 > 11 > 1 > 3.34e-03 g/l > 2-[3,4-dimethoxy-6-oxo-1-(prop-2-en-1-yl)cyclohexa-2,4-dien-1-yl]-1-(3,4-dimethoxyphenyl)propyl acetate > 0 > NP0170390 > 2-[3,4-dimethoxy-6-oxo-1-(prop-2-en-1-yl)cyclohexa-2,4-dien-1-yl]-1-(3,4-dimethoxyphenyl)propyl acetate $$$$