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0 0 10 16 1 0 0 0 0 10 39 1 0 0 0 0 11 14 1 0 0 0 0 11 17 2 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 13 43 1 0 0 0 0 13 44 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 15 18 1 0 0 0 0 15 47 1 0 0 0 0 15 48 1 0 0 0 0 16 49 1 0 0 0 0 16 50 1 0 0 0 0 16 51 1 0 0 0 0 17 20 1 0 0 0 0 17 52 1 0 0 0 0 18 19 1 0 0 0 0 18 53 1 0 0 0 0 18 54 1 0 0 0 0 19 21 1 0 0 0 0 19 55 1 0 0 0 0 19 56 1 0 0 0 0 20 22 2 0 0 0 0 20 57 1 0 0 0 0 21 24 1 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 26 1 0 0 0 0 23 27 1 0 0 0 0 23 58 1 0 0 0 0 23 59 1 0 0 0 0 24 60 1 0 0 0 0 24 61 1 0 0 0 0 24 62 1 0 0 0 0 25 63 1 0 0 0 0 25 64 1 0 0 0 0 25 65 1 0 0 0 0 26 28 1 0 0 0 0 26 30 2 0 0 0 0 27 29 1 0 0 0 0 27 66 1 0 0 0 0 28 29 1 0 0 0 0 28 67 1 0 0 0 0 29 68 1 0 0 0 0 29 69 1 0 0 0 0 30 71 1 0 0 0 0 30 72 1 0 0 0 0 M END > 10 16 6 27 2 6 28 3 5 4 12 5 5 31 6 6 32 6 > InChI=1S/C27H44O3/c1-18(8-6-14-26(3,4)30)23-12-13-24-20(9-7-15-27(23,24)5)10-11-21-16-22(28)17-25(29)19(21)2/h10-11,18,22-25,28-30H,2,6-9,12-17H2,1,3-5H3/b20-10+,21-11-/t18-,22-,23-,24+,25+,27-/m1/s1 > GMRQFYUYWCNGIN-NKMMMXOESA-N > 1/0/N:16,30,24,25,12,18,13,15,14,17,20,7,8,19,9,23,29,10,26,11,22,27,5,6,28,21,4,2,3,1/E:(3,4)/it:im/rA:74cOOOCCCCCCCCCCCCCCCCCCCCCCCCCCCHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHH/rB:;;;s4;s4;s5;s6s7;s4;s5;s6;s4;s9;s11s13;s10;s10;d11;s15;s18;s17;s1s19;d20;s22;s21;s21;s22;s2s23;s3s26;s27s28;d26;s5;s6;s7;s7;s8;s8;s9;s9;s10;s12;s12;s12;s13;s13;s14;s14;s15;s15;s16;s16;s16;s17;s18;s18;s19;s19;s20;s23;s23;s24;s24;s24;s25;s25;s25;s27;s28;s29;s29;s1;s30;s30;s2;s3;/rC:4.9623,-3.0202,4.808;-5.413,-1.3193,-6.372;-3.3853,2.0887,-4.3708;.9601,.3076,.1194;1.3481,1.4001,1.1911;-.6055,.3095,.2639;.2181,2.467,1.1395;-.9588,1.8151,.3902;1.4509,-1.1627,.4107;2.808,1.9637,1.4084;-1.3128,-.5893,-.6716;1.4351,.7215,-1.3168;.4798,-2.3176,.0169;-.7071,-1.9119,-.8999;3.879,.8852,1.7842;3.359,2.9502,.3338;-2.4376,-.1967,-1.3103;3.6537,.1683,3.1461;4.4594,-1.129,3.4098;-3.1901,-.8619,-2.2313;3.9922,-1.9834,4.6363;-4.2307,-.3879,-2.9563;-4.856,-1.2258,-3.9905;2.6262,-2.7001,4.4198;3.9717,-1.1703,5.961;-4.7554,.8888,-2.8706;-4.7377,-.5472,-5.3828;-4.7301,1.6883,-4.1056;-5.3019,.8991,-5.3199;-5.2862,1.3702,-1.7333;1.1126,.9274,2.1467;-.8763,-.1122,1.2428;-.0871,2.7734,2.1461;.5043,3.3788,.617;-1.0517,2.2693,-.6009;-1.9045,1.9714,.9173;1.6338,-1.2841,1.4786;2.4226,-1.357,-.0504;2.7359,2.6023,2.297;1.1833,1.7545,-1.5601;1.0019,.0983,-2.0988;2.5148,.6141,-1.419;1.0342,-3.1385,-.4483;.048,-2.7353,.9328;-.3584,-1.9486,-1.9356;-1.4617,-2.6977,-.7945;4.871,1.3435,1.847;3.9484,.161,.9722;4.2722,3.4362,.6851;2.6648,3.7588,.1101;3.61,2.4553,-.6014;-2.7657,.7086,-1.0933;3.8492,.8913,3.9418;2.6148,-.1135,3.2567;4.4196,-1.7585,2.5157;5.5074,-.8441,3.5381;-2.9216,-1.8001,-2.4122;-5.9105,-1.3787,-3.7389;-4.4274,-2.2297,-4.0702;2.6258,-3.2768,3.4929;2.4139,-3.3916,5.2383;1.7943,-1.9952,4.3748;3.7969,-1.8192,6.8214;4.9205,-.6537,6.1175;3.1772,-.4208,5.9538;-3.6826,-.5067,-5.6733;-5.2968,2.6217,-4.0229;-5.0848,1.4253,-6.2531;-6.3905,.8486,-5.2244;4.9357,-3.5466,3.9809;-5.6605,2.2882,-1.6769;-5.3234,.8282,-.9011;-4.98,-2.1995,-6.346;-3.1247,2.6523,-3.6108; > C27 H44 O3 > 416.6365 > O([H])C(C([H])([H])[H])(C([H])([H])[H])C([H])([H])C([H])([H])C([H])([H])[C@@]([H])(C([H])([H])[H])[C@@]1([H])C([H])([H])C([H])([H])[C@@]2([H])/C(=C(\[H])/C(/[H])=C3\C(=C([H])[H])[C@]([H])(C([H])([H])[C@@]([H])(C\3([H])[H])O[H])O[H])/C([H])([H])C([H])([H])C([H])([H])[C@]12C([H])([H])[H] > 4444108 $$$$