Mrv1652309122216252D 28 29 0 0 1 0 999 V2000 1.0164 -4.2355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 -4.9500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2539 -4.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6664 -4.2355 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6664 -5.6645 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2539 -6.3789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 -6.3789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0164 -7.0934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1914 -7.0934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2211 -6.3789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0461 -6.3789 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1914 -5.6645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2211 -4.9500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0164 -5.6645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4914 -5.6645 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9039 -4.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4914 -4.2355 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7289 -4.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1414 -4.2355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9664 -4.2355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3789 -3.5211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2039 -3.5211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6164 -4.2355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4414 -4.2355 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8539 -3.5211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2039 -4.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6164 -5.6645 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3789 -4.9500 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 3 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 2 0 0 0 0 7 14 1 0 0 0 0 5 15 1 6 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 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 23 24 1 0 0 0 0 24 25 1 0 0 0 0 23 26 1 0 0 0 0 26 27 1 0 0 0 0 26 28 2 0 0 0 0 20 28 1 0 0 0 0 M END > NP0329746 > NP-MRD > COC(=O)[C@@H](CC1=CC=C(O)C(O)=C1)OC(=O)\C=C\C1=CC=C(OC)C(O)=C1 > InChI=1S/C20H20O8/c1-26-17-7-4-12(9-16(17)23)5-8-19(24)28-18(20(25)27-2)11-13-3-6-14(21)15(22)10-13/h3-10,18,21-23H,11H2,1-2H3/b8-5+/t18-/m1/s1 > TUYFFOLCPXHZKL-KRZKXXONSA-N > C20H20O8 > 388.372 > 388.115817604 > 6 > 48 > 38.8842918737886 > 1 > 3 > 0 > 1 > (2R)-3-(3,4-dihydroxyphenyl)-1-methoxy-1-oxopropan-2-yl (2E)-3-(3-hydroxy-4-methoxyphenyl)prop-2-enoate > 3.2959143929999994 > 0 > 2 > 0 > 9.932469353831877 > 9.172905692143761 > -4.883600428902159 > 122.52000000000001 > 100.20150000000001 > 9 > 1 > (2R)-3-(3,4-dihydroxyphenyl)-1-methoxy-1-oxopropan-2-yl (2E)-3-(3-hydroxy-4-methoxyphenyl)prop-2-enoate > 0 > NP0329746 > (2r)-3-(3,4-dihydroxyphenyl)-1-methoxy-1-oxopropan-2-yl (2e)-3-(3-hydroxy-4-methoxyphenyl)prop-2-enoate $$$$