Mrv1652309102212202D 33 34 0 0 0 0 999 V2000 2.8579 -4.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5724 -4.5375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5724 -5.3625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2868 -5.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2868 -6.6000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0013 -7.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7158 -6.6000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4302 -7.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4302 -7.8375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1447 -6.6000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5572 -7.3145 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8592 -6.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8592 -5.3625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5737 -6.6000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2881 -6.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0026 -6.6000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7171 -6.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4315 -6.6000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1460 -6.1875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4315 -7.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1460 -7.8375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7171 -7.8375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7171 -8.6625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0026 -9.0750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0026 -7.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7322 -5.8855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1447 -5.1711 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9072 -5.8855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4947 -5.1711 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5724 -7.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8579 -6.6000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8579 -5.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1434 -5.3625 0.0000 O 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 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 2 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 22 25 2 0 0 0 0 16 25 1 0 0 0 0 10 26 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 5 30 2 0 0 0 0 30 31 1 0 0 0 0 31 32 2 0 0 0 0 3 32 1 0 0 0 0 32 33 1 0 0 0 0 M END > NP0298837 > NP-MRD > COC1=CC(\C=C\C(=O)C(O)(C(O)CO)C(=O)\C=C\C2=CC(O)=C(O)C(OC)=C2)=CC=C1O > InChI=1S/C23H24O10/c1-32-17-10-13(3-6-15(17)25)4-7-19(27)23(31,21(29)12-24)20(28)8-5-14-9-16(26)22(30)18(11-14)33-2/h3-11,21,24-26,29-31H,12H2,1-2H3/b7-4+,8-5+ > BZMRATNLWMMCHK-NSLJXJERSA-N > C23H24O10 > 460.435 > 460.136946973 > 10 > 57 > 46.07962319719914 > 1 > 6 > 0 > 1 > (1E,6E)-1-(3,4-dihydroxy-5-methoxyphenyl)-4-(1,2-dihydroxyethyl)-4-hydroxy-7-(4-hydroxy-3-methoxyphenyl)hepta-1,6-diene-3,5-dione > 1.8613217459999993 > 0 > 2 > 0 > 9.669660918988644 > 9.09157846143209 > -2.992173956810614 > 173.98 > 119.34919999999998 > 10 > 0 > (1E,6E)-1-(3,4-dihydroxy-5-methoxyphenyl)-4-(1,2-dihydroxyethyl)-4-hydroxy-7-(4-hydroxy-3-methoxyphenyl)hepta-1,6-diene-3,5-dione > 0 > NP0298837 > (1e,6e)-1-(3,4-dihydroxy-5-methoxyphenyl)-4-(1,2-dihydroxyethyl)-4-hydroxy-7-(4-hydroxy-3-methoxyphenyl)hepta-1,6-diene-3,5-dione $$$$