Mrv0541 05061309552D 96107 0 0 0 0 999 V2000 7.6042 0.5700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4976 -3.4807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5999 3.1675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3186 0.9825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7526 -4.2653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7290 3.9824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3186 -0.6675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1386 -3.9223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0112 2.9440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0331 -2.7300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3186 -3.9675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6598 -3.3347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4121 -4.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9090 2.8459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0584 1.4248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1361 0.0008 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4332 -1.3969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1752 -1.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0318 -1.4925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1355 0.9074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6042 -0.2550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6907 -3.3092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2411 2.6484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3186 -3.1425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8349 -3.3228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5734 2.0922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6881 -0.6122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4608 -1.4925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0331 0.5700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2005 -4.8784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4992 4.2781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7463 -1.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0331 -0.2550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3936 -4.7069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1403 3.7589 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6709 -0.1707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0318 -0.6675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7999 0.1537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7476 -3.1425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0331 -4.3800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0620 -4.0551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8143 -4.7516 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7295 2.9321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8788 1.5110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3738 -1.5684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9560 0.9936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8897 -1.4925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9258 -0.9553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2848 -0.5137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7463 -0.2550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4409 0.3262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7328 -1.1268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2614 0.4124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7476 -3.9675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6392 -4.7635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2144 2.2647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1053 -0.4275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8897 -0.6675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4357 -2.5245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1120 1.8335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4608 -0.6675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9877 -1.9115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5969 1.1661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6042 -2.7300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4622 -2.6614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7530 2.0060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4951 -0.4407 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7476 0.9825 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4555 -5.6630 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6282 5.0929 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7360 -2.6847 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7476 -0.6675 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8415 -5.3200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9106 4.0545 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5157 0.7370 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4175 -1.3137 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2479 0.7668 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4621 -2.7300 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0331 -5.2050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8869 -4.0670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3915 -5.4601 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0650 3.6858 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6635 1.2561 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4621 -4.3800 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0413 -5.4839 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0349 2.3509 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7620 -1.1532 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8897 -3.1425 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9085 -1.9675 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2681 2.6735 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6287 -2.3530 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2915 1.7473 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6042 -1.9050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1752 -0.2550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5590 -2.5840 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4174 1.2523 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4 1 2 0 0 0 0 5 2 2 0 0 0 0 6 3 2 0 0 0 0 21 1 1 0 0 0 0 21 7 2 0 0 0 0 22 2 1 0 0 0 0 22 8 2 0 0 0 0 23 3 1 0 0 0 0 23 9 2 0 0 0 0 24 10 2 0 0 0 0 24 11 1 0 0 0 0 25 12 2 0 0 0 0 25 13 1 0 0 0 0 26 14 2 0 0 0 0 26 15 1 0 0 0 0 27 16 2 0 0 0 0 27 17 1 0 0 0 0 28 18 1 0 0 0 0 29 4 1 0 0 0 0 30 5 1 0 0 0 0 31 6 1 0 0 0 0 32 19 2 0 0 0 0 32 28 1 0 0 0 0 33 7 1 0 0 0 0 33 29 2 0 0 0 0 34 8 1 0 0 0 0 34 30 2 0 0 0 0 35 9 1 0 0 0 0 35 31 2 0 0 0 0 36 16 1 0 0 0 0 37 19 1 0 0 0 0 38 20 2 0 0 0 0 39 10 1 0 0 0 0 40 11 2 0 0 0 0 41 12 1 0 0 0 0 42 13 2 0 0 0 0 43 14 1 0 0 0 0 44 15 2 0 0 0 0 45 17 2 0 0 0 0 46 20 1 0 0 0 0 47 18 1 0 0 0 0 48 36 2 0 0 0 0 48 45 1 0 0 0 0 49 38 1 0 0 0 0 50 37 2 0 0 0 0 51 46 2 0 0 0 0 52 48 1 0 0 0 0 52 49 1 0 0 0 0 53 50 1 0 0 0 0 53 51 1 0 0 0 0 54 39 2 0 0 0 0 54 40 1 0 0 0 0 55 41 2 0 0 0 0 55 42 1 0 0 0 0 56 43 2 0 0 0 0 56 44 1 0 0 0 0 57 49 2 0 0 0 0 57 51 1 0 0 0 0 58 21 1 0 0 0 0 58 47 1 0 0 0 0 59 22 1 0 0 0 0 60 23 1 0 0 0 0 61 28 2 0 0 0 0 61 50 1 0 0 0 0 62 52 1 0 0 0 0 62 59 1 0 0 0 0 63 53 1 0 0 0 0 63 60 1 0 0 0 0 64 24 1 0 0 0 0 65 25 1 0 0 0 0 66 26 1 0 0 0 0 67 27 1 0 0 0 0 68 29 1 0 0 0 0 69 30 1 0 0 0 0 70 31 1 0 0 0 0 71 32 1 0 0 0 0 72 33 1 0 0 0 0 73 34 1 0 0 0 0 74 35 1 0 0 0 0 75 36 1 0 0 0 0 76 37 1 0 0 0 0 77 38 1 0 0 0 0 78 39 1 0 0 0 0 79 40 1 0 0 0 0 80 41 1 0 0 0 0 81 42 1 0 0 0 0 82 43 1 0 0 0 0 83 44 1 0 0 0 0 84 54 1 0 0 0 0 85 55 1 0 0 0 0 86 56 1 0 0 0 0 87 57 1 0 0 0 0 88 64 2 0 0 0 0 89 65 2 0 0 0 0 90 66 2 0 0 0 0 91 45 1 0 0 0 0 91 59 1 0 0 0 0 92 46 1 0 0 0 0 92 60 1 0 0 0 0 93 47 1 0 0 0 0 93 64 1 0 0 0 0 94 58 1 0 0 0 0 94 61 1 0 0 0 0 95 62 1 0 0 0 0 95 65 1 0 0 0 0 96 63 1 0 0 0 0 96 66 1 0 0 0 0 M END > CHEM031169 > chemdb > OC1=CC(O)=C2C(C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C(OC2=C1)C1=CC(O)=C(O)C=C1)C1=C(O)C2=C(OC(C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2C2=C(O)C=C(O)C3=C2OC(C(C3)OC(=O)C2=CC(O)=C(O)C(O)=C2)C2=CC(O)=C(O)C=C2)C2=CC(O)=C(O)C=C2)C=C1O > InChI=1S/C66H50O30/c67-27-16-36(75)48-45(17-27)91-59(22-2-5-30(69)34(73)8-22)62(95-65(89)25-12-41(80)55(85)42(81)13-25)52(48)49-38(77)20-46-51(57(49)87)53(63(60(92-46)23-3-6-31(70)35(74)9-23)96-66(90)26-14-43(82)56(86)44(83)15-26)50-37(76)19-32(71)28-18-47(93-64(88)24-10-39(78)54(84)40(79)11-24)58(94-61(28)50)21-1-4-29(68)33(72)7-21/h1-17,19-20,47,52-53,58-60,62-63,67-87H,18H2 > MHDUITHKUVVZLK-UHFFFAOYSA-N > C66H50O30 > 1323.0852 > 1322.23869026 > 27 > 126.16174830790409 > 0 > 21 > 0 > 0 > 2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-(3,4,5-trihydroxybenzoyloxy)-3,4-dihydro-2H-1-benzopyran-8-yl]-5,7-dihydroxy-3-(3,4,5-trihydroxybenzoyloxy)-3,4-dihydro-2H-1-benzopyran-6-yl]-5,7-dihydroxy-3,4-dihydro-2H-1-benzopyran-3-yl 3,4,5-trihydroxybenzoate > 4.62 > 9.190194663 > -3.53 > 1 > 12 > 0 > 8.112388202998604 > 7.635320862675035 > -5.548931352797571 > 531.4200000000002 > 326.31039999999945 > 14 > 0 > 3.90e-01 g/l > 2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-(3,4,5-trihydroxybenzoyloxy)-3,4-dihydro-2H-1-benzopyran-8-yl]-5,7-dihydroxy-3-(3,4,5-trihydroxybenzoyloxy)-3,4-dihydro-2H-1-benzopyran-6-yl]-5,7-dihydroxy-3,4-dihydro-2H-1-benzopyran-3-yl 3,4,5-trihydroxybenzoate > 0 > Epicatechin-(4beta->6)-epicatechin-(4beta->8)-epicatechin 3,3',3''-trigallate > 106533-64-6 $$$$