Mrv1652304292205412D 105110 0 0 0 0 999 V2000 0.2661 -3.6785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2661 -4.5035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4484 -4.9160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1629 -4.5035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1629 -3.6785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4484 -3.2660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4484 -2.4410 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1629 -2.0285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8774 -2.4410 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1629 -1.2035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8774 -3.2660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6843 -3.4376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9393 -4.2222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7462 -4.3937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2983 -3.7806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0433 -2.9960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2364 -2.8245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9814 -2.0398 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5335 -1.4267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3404 -1.5983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8925 -0.9852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6375 -0.2006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8306 -0.0290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2785 -0.6421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5756 0.7556 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7686 0.9271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5137 1.7117 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2166 0.3140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1896 0.4125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1896 1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9040 1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9040 2.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1896 2.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4751 2.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4751 1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7606 1.2375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0461 1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0461 2.4750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2925 1.9856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7606 2.8875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7606 3.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4751 4.1250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0461 4.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1896 3.7125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9040 4.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9040 4.9500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6185 3.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6185 1.2375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3330 1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0474 1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7619 1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7619 2.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4764 2.8875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.1909 2.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1909 1.6500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.9053 2.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0474 2.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3330 2.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0474 3.7125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.7619 4.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4764 3.7125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.7619 4.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4764 1.2375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.4764 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7619 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.1909 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6994 -1.1567 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2515 -0.5436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0584 -0.7151 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9965 0.2410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1052 -3.9521 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6573 -3.3390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4643 -3.5106 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4023 -2.5544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0012 -5.1783 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8082 -5.3498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0631 -6.1345 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3602 -4.7368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3872 -4.8353 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6422 -5.6199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4491 -5.7914 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0901 -6.2330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8774 -4.9160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8774 -5.7410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1629 -6.1535 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9636 -6.5615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9805 -4.9160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6950 -4.5035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6950 -3.6785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4095 -3.2660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1239 -3.6785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1239 -4.5035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4095 -4.9160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4095 -5.7410 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1239 -6.1535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8384 -5.7410 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1239 -6.9785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8384 -3.2660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5529 -3.6785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2674 -3.2660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5529 -4.5035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9805 -3.2660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9805 -2.4410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2661 -2.0285 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6950 -2.0285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 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 2 0 0 0 0 1 6 1 0 0 0 0 6 7 1 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 5 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 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 12 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 19 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 22 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 2 0 0 0 0 31 32 1 0 0 0 0 32 33 2 0 0 0 0 33 34 1 0 0 0 0 34 35 2 0 0 0 0 30 35 1 0 0 0 0 35 36 1 0 0 0 0 36 37 1 0 0 0 0 37 38 2 0 0 0 0 37 39 1 0 0 0 0 34 40 1 0 0 0 0 40 41 1 0 0 0 0 41 42 2 0 0 0 0 41 43 1 0 0 0 0 33 44 1 0 0 0 0 44 45 1 0 0 0 0 45 46 2 0 0 0 0 45 47 1 0 0 0 0 31 48 1 0 0 0 0 48 49 1 0 0 0 0 49 50 2 0 0 0 0 50 51 1 0 0 0 0 51 52 2 0 0 0 0 52 53 1 0 0 0 0 53 54 1 0 0 0 0 54 55 2 0 0 0 0 54 56 1 0 0 0 0 52 57 1 0 0 0 0 57 58 2 0 0 0 0 49 58 1 0 0 0 0 57 59 1 0 0 0 0 59 60 1 0 0 0 0 60 61 2 0 0 0 0 60 62 1 0 0 0 0 51 63 1 0 0 0 0 63 64 1 0 0 0 0 64 65 2 0 0 0 0 64 66 1 0 0 0 0 21 67 1 0 0 0 0 67 68 1 0 0 0 0 68 69 2 0 0 0 0 68 70 1 0 0 0 0 15 71 1 0 0 0 0 71 72 1 0 0 0 0 72 73 2 0 0 0 0 72 74 1 0 0 0 0 14 75 1 0 0 0 0 75 76 1 0 0 0 0 76 77 2 0 0 0 0 76 78 1 0 0 0 0 13 79 1 0 0 0 0 79 80 1 0 0 0 0 80 81 2 0 0 0 0 80 82 1 0 0 0 0 4 83 1 0 0 0 0 83 84 1 0 0 0 0 84 85 2 0 0 0 0 84 86 1 0 0 0 0 2 87 1 0 0 0 0 87 88 1 0 0 0 0 88 89 2 0 0 0 0 89 90 1 0 0 0 0 90 91 2 0 0 0 0 91 92 1 0 0 0 0 92 93 2 0 0 0 0 88 93 1 0 0 0 0 93 94 1 0 0 0 0 94 95 1 0 0 0 0 95 96 2 0 0 0 0 95 97 1 0 0 0 0 91 98 1 0 0 0 0 98 99 1 0 0 0 0 99100 2 0 0 0 0 99101 1 0 0 0 0 89102 1 0 0 0 0 102103 1 0 0 0 0 103104 2 0 0 0 0 103105 1 0 0 0 0 M END > NP0082618 > NP-MRD > CC(=O)OC1=CC(OC(C)=O)=C(OC2=CC(OC(C)=O)=C(OC3=C(OC(C)=O)C(OC(C)=O)=C(OC(C)=O)C=C3OC3=CC(OC(C)=O)=C(OC4=C(OC5=CC(OC(C)=O)=C(OC(C)=O)C(OC(C)=O)=C5)C=C(OC(C)=O)C(OC(C)=O)=C4OC(C)=O)C(OC(C)=O)=C3)C(OC(C)=O)=C2)C(OC(C)=O)=C1 > InChI=1S/C68H58O37/c1-27(69)85-43-17-49(88-30(4)72)60(50(18-43)89-31(5)73)103-46-23-53(92-34(8)76)62(54(24-46)93-35(9)77)105-66-58(26-56(95-37(11)79)64(98-40(14)82)68(66)100-42(16)84)102-45-21-51(90-32(6)74)61(52(22-45)91-33(7)75)104-65-57(25-55(94-36(10)78)63(97-39(13)81)67(65)99-41(15)83)101-44-19-47(86-28(2)70)59(96-38(12)80)48(20-44)87-29(3)71/h17-26H,1-16H3 > YKUKJEPCCWNVRQ-UHFFFAOYSA-N > C68H58O37 > 1467.175 > 1466.265692808 > 16 > 163 > 138.1942342873504 > 0 > 0 > 0 > 0 > 3-(acetyloxy)-2-[2,3,4-tris(acetyloxy)-6-[3,5-bis(acetyloxy)-4-[2,3,4-tris(acetyloxy)-6-[3,4,5-tris(acetyloxy)phenoxy]phenoxy]phenoxy]phenoxy]-5-[2,4,6-tris(acetyloxy)phenoxy]phenyl acetate > 5.04 > 3.1908573203333335 > -5.96 > 1 > 6 > 0 > -3.104861696381946 > 466.95000000000005 > 335.38039999999995 > 42 > 0 > 1.61e-03 g/l > 3-(acetyloxy)-2-[2,3,4-tris(acetyloxy)-6-[3,5-bis(acetyloxy)-4-[2,3,4-tris(acetyloxy)-6-[3,4,5-tris(acetyloxy)phenoxy]phenoxy]phenoxy]phenoxy]-5-[2,4,6-tris(acetyloxy)phenoxy]phenyl acetate > 0 > NP0082618 > Pseudohexafuhalol C hexadecaacetate $$$$