119205 -OEChem-03282404162D 48 50 0 1 0 0 0 0 0999 V2000 6.5468 2.7756 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8255 3.2368 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9035 -2.3860 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.9268 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3898 -1.0478 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.9268 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3776 1.1664 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.4641 1.5732 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.0468 1.9096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5856 0.1883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.0732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5686 2.5677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5366 -0.1207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.0732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7445 -1.0989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2798 0.5484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.4268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.4268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6956 -1.4079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.4268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2308 0.2394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.4268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4387 -0.7388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.9268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8546 -2.6951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.4268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8958 0.7763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9441 1.9108 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4616 1.4488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5484 2.2740 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9659 0.1667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4993 -0.4257 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3860 1.6558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9875 0.9655 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2838 -1.5137 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1509 1.1548 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -0.1168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -0.1168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6916 0.6542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -1.7368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8505 -0.6329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -3.2368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6630 -3.2847 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4442 -2.8866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0461 -2.1054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -0.8899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.1168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -1.9638 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 12 1 0 0 0 0 2 12 2 0 0 0 0 3 19 1 0 0 0 0 3 25 1 0 0 0 0 4 20 1 0 0 0 0 4 26 1 0 0 0 0 5 23 1 0 0 0 0 5 41 1 0 0 0 0 6 24 1 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 6 0 0 0 7 27 1 0 0 0 0 8 11 1 1 0 0 0 8 12 1 0 0 0 0 8 28 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 13 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 14 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 14 17 2 0 0 0 0 14 18 1 0 0 0 0 15 19 1 0 0 0 0 15 35 1 0 0 0 0 16 21 2 0 0 0 0 16 36 1 0 0 0 0 17 20 1 0 0 0 0 17 37 1 0 0 0 0 18 22 2 0 0 0 0 18 38 1 0 0 0 0 19 23 2 0 0 0 0 20 24 2 0 0 0 0 21 23 1 0 0 0 0 21 39 1 0 0 0 0 22 24 1 0 0 0 0 22 40 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 M END > 119205 > 1 > 469 > 6 > 2 > 6 > AAADceB4OAAAAAAAAAAAAAAAAAAAASAAAAAwYAAAAAAAAAABQAAAGgAACAAADQSgmAIyDoAABgCIAiDSCAACCAAgIAAIiAEGiIgNJjKGMRqCcCMkwBELuAeKyPCOoAABAAAAQABAAAIAAACAAAAAAAAAAA== > (3R,4R)-3,4-bis[(4-hydroxy-3-methoxy-phenyl)methyl]tetrahydrofuran-2-one > (3R,4R)-3,4-bis[(4-hydroxy-3-methoxyphenyl)methyl]-2-oxolanone > (3R,4R)-3,4-bis[(4-hydroxy-3-methoxyphenyl)methyl]oxolan-2-one > (3R,4R)-3,4-bis[(4-hydroxy-3-methoxyphenyl)methyl]oxolan-2-one > (3R,4R)-3,4-bis[(3-methoxy-4-oxidanyl-phenyl)methyl]oxolan-2-one > (3R,4R)-3,4-divanillyltetrahydrofuran-2-one > InChI=1S/C20H22O6/c1-24-18-9-12(3-5-16(18)21)7-14-11-26-20(23)15(14)8-13-4-6-17(22)19(10-13)25-2/h3-6,9-10,14-15,21-22H,7-8,11H2,1-2H3/t14-,15+/m0/s1 > MATGKVZWFZHCLI-LSDHHAIUSA-N > 3.3 > 358.14163842 > C20H22O6 > 358.4 > COC1=C(C=CC(=C1)CC2COC(=O)C2CC3=CC(=C(C=C3)O)OC)O > COC1=C(C=CC(=C1)C[C@H]2COC(=O)[C@@H]2CC3=CC(=C(C=C3)O)OC)O > 85.2 > 358.14163842 > 0 > 26 > 2 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 13 15 8 13 16 8 14 17 8 14 18 8 15 19 8 16 21 8 17 20 8 18 22 8 19 23 8 20 24 8 21 23 8 22 24 8 7 10 6 8 11 5 $$$$