Mrv1652306192123273D 37 39 0 0 0 0 999 V2000 2.3240 3.7287 1.3473 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5861 2.6645 0.7586 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6054 2.5592 -0.6085 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3006 3.4265 -1.4578 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2758 3.2264 -2.8357 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9818 4.1192 -3.5972 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5637 2.1569 -3.3785 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5316 1.9179 -4.8231 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1160 2.6524 -5.6173 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7646 0.7507 -5.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7289 0.5446 -6.6765 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1403 -0.0242 -4.4054 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6669 -1.2090 -4.7684 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9223 -1.4067 -4.1706 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6917 -2.5312 -4.4793 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2086 -3.4685 -5.3825 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9915 -4.5501 -5.6562 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9654 -3.3028 -5.9815 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1964 -2.1767 -5.6701 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1632 0.2130 -3.0375 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8658 1.2870 -2.5445 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8638 1.4872 -1.1509 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1324 0.5344 -0.2391 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3928 3.6364 1.1285 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1999 3.6602 2.4324 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9353 4.7016 1.0291 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8747 4.2659 -1.0796 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8832 3.8695 -4.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2440 1.2835 -7.0633 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3158 -0.6818 -3.4613 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6637 -2.6730 -4.0157 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5343 -5.1055 -6.3087 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5767 -4.0306 -6.6863 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7780 -2.0623 -6.1405 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8288 -0.2147 0.1504 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6831 0.0182 -0.7554 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3288 1.0663 0.5997 H 0 0 0 0 0 0 0 0 0 0 0 0 3 2 1 0 0 0 0 22 23 1 0 0 0 0 4 5 1 0 0 0 0 10 11 1 0 0 0 0 5 7 2 0 0 0 0 12 13 1 0 0 0 0 3 4 2 0 0 0 0 13 14 2 0 0 0 0 21 22 2 0 0 0 0 14 15 1 0 0 0 0 22 3 1 0 0 0 0 15 16 2 0 0 0 0 21 20 1 0 0 0 0 16 18 1 0 0 0 0 7 8 1 0 0 0 0 18 19 2 0 0 0 0 19 13 1 0 0 0 0 8 10 1 0 0 0 0 16 17 1 0 0 0 0 10 12 2 0 0 0 0 2 1 1 0 0 0 0 12 20 1 0 0 0 0 5 6 1 0 0 0 0 21 7 1 0 0 0 0 8 9 2 0 0 0 0 4 27 1 0 0 0 0 23 35 1 0 0 0 0 23 36 1 0 0 0 0 23 37 1 0 0 0 0 11 29 1 0 0 0 0 14 30 1 0 0 0 0 15 31 1 0 0 0 0 18 33 1 0 0 0 0 19 34 1 0 0 0 0 17 32 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 6 28 1 0 0 0 0 M END > NP0029987 > NP-MRD > [H]OC1=C([H])C([H])=C(C([H])=C1[H])C1=C(O[H])C(=O)C2=C(O[H])C([H])=C(OC([H])([H])[H])C(=C2O1)C([H])([H])[H] > InChI=1S/C17H14O6/c1-8-12(22-2)7-11(19)13-14(20)15(21)17(23-16(8)13)9-3-5-10(18)6-4-9/h3-7,18-19,21H,1-2H3 > HCRLNUIDURQGLT-UHFFFAOYSA-N > C17H14O6 > 314.293 > 314.079038171 > 6 > 37 > 32.066167634747586 > 1 > 3 > 0 > 1 > 3,5-dihydroxy-2-(4-hydroxyphenyl)-7-methoxy-8-methyl-4H-chromen-4-one > 2.48 > 3.119180230999999 > -3.77 > 0 > 3 > 0 > 8.556010005656796 > 7.580397425315911 > -3.841586425836449 > 96.22000000000001 > 84.4048 > 2 > 1 > 5.29e-02 g/l > 3,5-dihydroxy-2-(4-hydroxyphenyl)-7-methoxy-8-methylchromen-4-one > 0 > NP0029987 > tupichinol E $$$$