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0 38 10 1 0 0 0 0 38 18 1 0 0 0 0 38 22 2 0 0 0 0 39 15 1 0 0 0 0 39 28 1 0 0 0 0 40 16 1 0 0 0 0 40 29 1 0 0 0 0 40 39 1 0 0 0 0 41 17 1 0 0 0 0 41 30 1 0 0 0 0 42 18 1 0 0 0 0 42 31 1 0 0 0 0 42 41 1 0 0 0 0 43 11 1 0 0 0 0 44 12 1 0 0 0 0 45 13 1 0 0 0 0 46 14 1 0 0 0 0 47 19 1 0 0 0 0 47 43 2 0 0 0 0 48 20 1 0 0 0 0 48 44 2 0 0 0 0 49 21 1 0 0 0 0 49 45 2 0 0 0 0 50 22 1 0 0 0 0 50 46 2 0 0 0 0 51 27 1 0 0 0 0 52 32 1 0 0 0 0 53 33 1 0 0 0 0 54 34 1 0 0 0 0 55 23 1 0 0 0 0 56 24 1 0 0 0 0 57 25 1 0 0 0 0 58 26 1 0 0 0 0 59 51 1 0 0 0 0 60 52 1 0 0 0 0 61 53 1 0 0 0 0 62 54 1 0 0 0 0 63 59 1 0 0 0 0 64 60 1 0 0 0 0 65 61 1 0 0 0 0 66 62 1 0 0 0 0 67 63 1 0 0 0 0 68 64 1 0 0 0 0 69 65 1 0 0 0 0 70 66 1 0 0 0 0 71 67 1 0 0 0 0 72 68 1 0 0 0 0 73 69 1 0 0 0 0 74 70 1 0 0 0 0 75 1 1 0 0 0 0 75 23 1 0 0 0 0 75 24 1 0 0 0 0 76 2 1 0 0 0 0 76 25 1 0 0 0 0 76 26 1 0 0 0 0 77 27 1 0 0 0 0 78 43 1 0 0 0 0 79 44 1 0 0 0 0 80 45 1 0 0 0 0 81 46 1 0 0 0 0 82 55 2 0 0 0 0 83 55 1 0 0 0 0 84 56 2 0 0 0 0 85 57 2 0 0 0 0 86 58 2 0 0 0 0 87 59 1 0 0 0 0 88 60 1 0 0 0 0 89 61 1 0 0 0 0 90 62 1 0 0 0 0 91 63 1 0 0 0 0 92 64 1 0 0 0 0 93 65 1 0 0 0 0 94 66 1 0 0 0 0 95 67 1 0 0 0 0 96 68 1 0 0 0 0 97 69 1 0 0 0 0 98 70 1 0 0 0 0 99 75 1 0 0 0 0 100 76 1 0 0 0 0 101 3 1 0 0 0 0 101 47 1 0 0 0 0 102 4 1 0 0 0 0 102 48 1 0 0 0 0 103 5 1 0 0 0 0 103 49 1 0 0 0 0 104 6 1 0 0 0 0 104 50 1 0 0 0 0 105 32 1 0 0 0 0 105 56 1 0 0 0 0 106 33 1 0 0 0 0 106 57 1 0 0 0 0 107 34 1 0 0 0 0 107 58 1 0 0 0 0 108 28 1 0 0 0 0 108 71 1 0 0 0 0 109 29 1 0 0 0 0 109 73 1 0 0 0 0 110 30 1 0 0 0 0 110 72 1 0 0 0 0 111 31 1 0 0 0 0 111 74 1 0 0 0 0 112 51 1 0 0 0 0 112 71 1 0 0 0 0 113 52 1 0 0 0 0 113 72 1 0 0 0 0 114 53 1 0 0 0 0 114 73 1 0 0 0 0 115 54 1 0 0 0 0 115 74 1 0 0 0 0 M END > CHEM030738 > chemdb > COC1=C(O)C=CC(CC(COC2OC(CO)C(O)C(O)C2O)C(COC2OC(COC(=O)CC(C)(O)CC(=O)OCC3OC(OCC(CC4=CC(OC)=C(O)C=C4)C(COC4OC(COC(=O)CC(C)(O)CC(O)=O)C(O)C(O)C4O)CC4=CC(OC)=C(O)C=C4)C(O)C(O)C3O)C(O)C(O)C2O)CC2=CC(OC)=C(O)C=C2)=C1 > InChI=1S/C76H106O39/c1-75(99,23-55(82)83)24-56(84)105-32-52-60(88)64(92)68(96)72(113-52)110-30-41(17-37-9-13-45(80)49(21-37)103-5)42(18-38-10-14-46(81)50(22-38)104-6)31-111-74-70(98)66(94)62(90)54(115-74)34-107-58(86)26-76(2,100)25-57(85)106-33-53-61(89)65(93)69(97)73(114-53)109-29-40(16-36-8-12-44(79)48(20-36)102-4)39(15-35-7-11-43(78)47(19-35)101-3)28-108-71-67(95)63(91)59(87)51(27-77)112-71/h7-14,19-22,39-42,51-54,59-74,77-81,87-100H,15-18,23-34H2,1-6H3,(H,82,83) > DQIYBQNLWFVQIW-UHFFFAOYSA-N > C76H106O39 > 1643.6314 > 1642.63112365 > 36 > 161.37523375967908 > 0 > 20 > 0 > 0 > 5-({6-[4-({6-[({5-[(6-{2,3-bis[(4-hydroxy-3-methoxyphenyl)methyl]-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}butoxy}-3,4,5-trihydroxyoxan-2-yl)methoxy]-3-hydroxy-3-methyl-5-oxopentanoyl}oxy)methyl]-3,4,5-trihydroxyoxan-2-yl}oxy)-2,3-bis[(4-hydroxy-3-methoxyphenyl)methyl]butoxy]-3,4,5-trihydroxyoxan-2-yl}methoxy)-3-hydroxy-3-methyl-5-oxopentanoic acid > 0.99 > -1.920689525333329 > -3.53 > 1 > 8 > -1 > 9.659599690231724 > 3.753162610506407 > -3.947276317347879 > 611.3300000000004 > 386.0259999999996 > 44 > 0 > 4.90e-01 g/l > 5-({6-[4-({6-[({5-[(6-{2,3-bis[(4-hydroxy-3-methoxyphenyl)methyl]-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}butoxy}-3,4,5-trihydroxyoxan-2-yl)methoxy]-3-hydroxy-3-methyl-5-oxopentanoyl}oxy)methyl]-3,4,5-trihydroxyoxan-2-yl}oxy)-2,3-bis[(4-hydroxy-3-methoxyphenyl)methyl]butoxy]-3,4,5-trihydroxyoxan-2-yl}methoxy)-3-hydroxy-3-methyl-5-oxopentanoic acid > 0 > Flaxseed lignan-HMGA oligomer $$$$