16152699 -OEChem-04182407482D 120156 0 1 0 0 0 0 0999 V2000 14.0671 0.7669 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9700 3.7096 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7467 -9.0345 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1420 -5.7986 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2938 -5.7009 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2554 0.6721 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9462 7.1751 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 14.0802 7.6751 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 16.7062 7.1404 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 14.9623 6.1336 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 15.8122 7.6751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6122 7.6543 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 15.9503 6.0264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0802 8.6751 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 13.1702 7.1682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8122 8.6751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0642 5.6058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9462 9.1751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6122 8.6959 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1520 5.6643 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1482 6.7733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6207 5.2216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1702 9.1819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1621 6.1266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7062 9.2098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6689 7.0980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2043 -6.0354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5834 8.3798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7963 5.8041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8094 4.8696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9623 10.2166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -11.8662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0594 4.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.3484 9.4411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3049 10.1190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9119 7.4816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1312 6.1029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1621 10.2235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8240 5.1077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6687 7.9038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0642 10.7444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3274 3.7707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5931 3.4952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1097 10.7894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1039 10.4596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4678 6.8924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8862 4.8143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0481 4.7807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5657 5.5767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1487 10.4885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3889 9.7675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3153 4.0584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5591 11.6490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0114 4.6722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5428 -12.1886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4338 3.7898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5745 11.8288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.1062 10.1567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4663 6.6732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5124 -11.0164 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5639 11.9562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.6995 9.2939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9625 8.8316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1433 5.7002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8875 11.1880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3622 1.9431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3351 2.5835 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2903 2.8575 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5430 12.1886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4641 4.0622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6006 11.7322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8121 11.3598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0894 4.6443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4934 7.5430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9107 3.2263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1782 4.8039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5640 -11.0008 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5305 -8.6720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5414 2.4216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1659 3.2157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5279 -8.6566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5787 -7.5312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9227 -1.3149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7393 3.4097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9586 -8.6178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 -3.6748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0016 -3.5643 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7519 2.3533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8878 -7.4584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4364 -1.4243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0925 5.5274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0754 9.2951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4158 5.1032 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7466 5.8400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5238 7.7008 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0511 7.0458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3940 -6.6256 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8185 -5.9510 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3812 -11.8271 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2509 -12.4331 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4511 2.9225 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6448 5.1201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1045 -11.3046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9972 -8.3558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5007 -1.5393 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3166 -1.4457 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9057 4.0070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9291 2.8195 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8238 -9.2230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7380 -8.0383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8316 -3.4203 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0090 -3.5760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4656 -3.9755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3878 -3.4763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7003 2.9712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 1.8658 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9717 -8.0727 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4796 -6.9917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9946 -0.9893 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0446 -1.5445 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 79 1 0 0 0 0 1 83 1 0 0 0 0 2 80 1 0 0 0 0 2 84 1 0 0 0 0 3 81 1 0 0 0 0 3 85 1 0 0 0 0 4 82 1 0 0 0 0 4 86 1 0 0 0 0 5 87 1 0 0 0 0 5 89 1 0 0 0 0 6 88 1 0 0 0 0 6 90 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 7 11 1 0 0 0 0 7 20 1 0 0 0 0 8 14 1 0 0 0 0 8 15 1 0 0 0 0 8 26 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 9 13 1 0 0 0 0 9 27 1 0 0 0 0 10 13 1 0 0 0 0 10 17 1 0 0 0 0 10 91 1 0 0 0 0 11 16 2 0 0 0 0 12 19 1 0 0 0 0 12 21 1 0 0 0 0 12 32 1 0 0 0 0 13 22 2 0 0 0 0 14 18 1 0 0 0 0 14 23 1 0 0 0 0 14 92 1 0 0 0 0 15 24 1 0 0 0 0 15 28 2 0 0 0 0 16 18 1 0 0 0 0 16 25 1 0 0 0 0 17 24 2 0 0 0 0 17 30 1 0 0 0 0 18 31 2 0 0 0 0 19 25 2 0 0 0 0 19 34 1 0 0 0 0 20 47 1 0 0 0 0 20 93 1 0 0 0 0 20 94 1 0 0 0 0 21 29 2 0 0 0 0 21 36 1 0 0 0 0 22 29 1 0 0 0 0 22 33 1 0 0 0 0 23 28 1 0 0 0 0 23 38 2 0 0 0 0 24 37 1 0 0 0 0 25 35 1 0 0 0 0 26 49 1 0 0 0 0 26 95 1 0 0 0 0 26 96 1 0 0 0 0 27 55 1 0 0 0 0 27 97 1 0 0 0 0 27 98 1 0 0 0 0 28 40 1 0 0 0 0 29 42 1 0 0 0 0 30 33 2 0 0 0 0 30 39 1 0 0 0 0 31 35 1 0 0 0 0 31 41 1 0 0 0 0 32 60 1 0 0 0 0 32 99 1 0 0 0 0 32100 1 0 0 0 0 33 43 1 0 0 0 0 34 36 2 0 0 0 0 34 45 1 0 0 0 0 35 44 2 0 0 0 0 36 48 1 0 0 0 0 37 39 2 0 0 0 0 37 46 1 0 0 0 0 38 41 1 0 0 0 0 38 50 1 0 0 0 0 39 54 1 0 0 0 0 40 46 1 0 0 0 0 40 51 2 0 0 0 0 41 53 2 0 0 0 0 42 43 2 0 0 0 0 42 52 1 0 0 0 0 43 56 1 0 0 0 0 44 45 1 0 0 0 0 44 57 1 0 0 0 0 45 58 2 0 0 0 0 46 59 2 0 0 0 0 47 49 1 0 0 0 0 47 75 2 0 0 0 0 48 52 2 0 0 0 0 48 62 1 0 0 0 0 49 76 2 0 0 0 0 50 51 1 0 0 0 0 50 61 2 0 0 0 0 51 63 1 0 0 0 0 52 66 1 0 0 0 0 53 57 1 0 0 0 0 53 61 1 0 0 0 0 54 56 2 0 0 0 0 54 64 1 0 0 0 0 55 60 1 0 0 0 0 55 77 2 0 0 0 0 56 67 1 0 0 0 0 57 65 2 0 0 0 0 58 62 1 0 0 0 0 58 65 1 0 0 0 0 59 63 1 0 0 0 0 59 64 1 0 0 0 0 60 78 2 0 0 0 0 61 69 1 0 0 0 0 62 68 2 0 0 0 0 63 71 2 0 0 0 0 64 70 2 0 0 0 0 65 72 1 0 0 0 0 66 67 2 0 0 0 0 66 68 1 0 0 0 0 67 70 1 0 0 0 0 68 73 1 0 0 0 0 69 71 1 0 0 0 0 69 72 2 0 0 0 0 70 74 1 0 0 0 0 71 74 1 0 0 0 0 72 73 1 0 0 0 0 73 74 2 0 0 0 0 75 79 1 0 0 0 0 75101 1 0 0 0 0 76 80 1 0 0 0 0 76102 1 0 0 0 0 77 81 1 0 0 0 0 77103 1 0 0 0 0 78 82 1 0 0 0 0 78104 1 0 0 0 0 79 80 2 0 0 0 0 81 82 2 0 0 0 0 83 87 1 0 0 0 0 83105 1 0 0 0 0 83106 1 0 0 0 0 84 88 1 0 0 0 0 84107 1 0 0 0 0 84108 1 0 0 0 0 85 89 1 0 0 0 0 85109 1 0 0 0 0 85110 1 0 0 0 0 86 90 1 0 0 0 0 86111 1 0 0 0 0 86112 1 0 0 0 0 87113 1 0 0 0 0 87114 1 0 0 0 0 88115 1 0 0 0 0 88116 1 0 0 0 0 89117 1 0 0 0 0 89118 1 0 0 0 0 90119 1 0 0 0 0 90120 1 0 0 0 0 M END > 16152699 > 1 > 6190 > 6 > 0 > 0 > AAADceB8OAAAAAAAAAAAAAAAAAAAAYIECBAwYMGCAAAAAADBQAAAGgAAAAAADwSgmAIwBoAABACAAiBCAAACCAAgIAAAiAAGiIgNJiKEMRqCOCKkwBEKqAeAwPAPoAABAAAQQADAAAYAACCAAQAACAAAAA== > InChI=1S/C84H30O6/c1-5-87-21-9-17-13-81-74-63-53-43-33-27-25-26-31-37(33)47(53)57-49-39(31)40-32(26)38-34-28(25)30-29(27)35-41-42-36(30)46-44(34)54-48(38)58-50(40)60-59(49)69(67(57)74)78-79-70(60)68(58)75-64(54)66-56(46)52(42)62-61-51(41)55(45(35)43)65(63)76(81)71(61)73-72(62)77(66)82(75)14-18-10-22(88-6-2-85-1)24-12-20(18)16-84(79,82)80(73)83(78,81)15-19(17)11-23(21)89-7-3-86-4-8-90-24/h9-12,76,78H,1-8,13-16H2 > PJCUCPHPQHUEEX-UHFFFAOYSA-N > 10.9 > 1134.20423867 > C84H30O6 > 1135.1 > C1COC2=C3C=C4CC56C7C8=C9C%10=C%11C8=C8C%12=C7C7%13C5=C5C%14=C%15C%16=C%17C%18=C%19C%16=C%16C%14C6(C9=C%16C6=C%19C9=C%14C%18=C%16C%18=C%14C%14=C(C%11=C%11C8=C8C%12=C%12C7(CC7=CC(=C(C=C7C%13)OCCOCCO3)OCCO1)C1=C5C%15=C3C%17=C%16C5=C3C1=C%12C1=C8C(=C%11%14)C%18=C51)C9=C6%10)CC4=C2 > C1COC2=C3C=C4CC56C7C8=C9C%10=C%11C8=C8C%12=C7C7%13C5=C5C%14=C%15C%16=C%17C%18=C%19C%16=C%16C%14C6(C9=C%16C6=C%19C9=C%14C%18=C%16C%18=C%14C%14=C(C%11=C%11C8=C8C%12=C%12C7(CC7=CC(=C(C=C7C%13)OCCOCCO3)OCCO1)C1=C5C%15=C3C%17=C%16C5=C3C1=C%12C1=C8C(=C%11%14)C%18=C51)C9=C6%10)CC4=C2 > 55.4 > 1134.20423867 > 0 > 90 > 0 > 6 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 10 17 3 12 32 3 14 23 3 15 24 8 15 28 8 16 18 8 16 25 8 17 24 8 17 30 8 18 31 8 19 25 8 19 34 8 21 29 8 21 36 8 22 29 8 22 33 8 23 28 8 23 38 8 24 37 8 25 35 8 28 40 8 29 42 8 30 33 8 30 39 8 31 35 8 31 41 8 33 43 8 34 36 8 34 45 8 35 44 8 36 48 8 37 39 8 37 46 8 38 41 8 38 50 8 39 54 8 40 46 8 40 51 8 41 53 8 42 43 8 42 52 8 43 56 8 44 45 8 44 57 8 45 58 8 46 59 8 47 49 8 47 75 8 48 52 8 48 62 8 49 76 8 50 51 8 50 61 8 51 63 8 52 66 8 53 57 8 53 61 8 54 56 8 54 64 8 55 60 8 55 77 8 56 67 8 57 65 8 58 62 8 58 65 8 59 63 8 59 64 8 60 78 8 61 69 8 62 68 8 63 71 8 64 70 8 65 72 8 66 67 8 66 68 8 67 70 8 68 73 8 69 71 8 69 72 8 7 20 3 70 74 8 71 74 8 72 73 8 73 74 8 75 79 8 76 80 8 77 81 8 78 82 8 79 80 8 8 26 3 81 82 8 9 27 3 $$$$