47 50 0 0001 0 0 0 0 0999 V2000 14.4251 -6.3906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 20.5485 -3.1645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 11.3017 -8.2400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 10.3976 -5.4454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 12.0825 -7.1303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 12.7606 -5.0755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 17.5279 -6.5550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 14.0963 -4.5001 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 13.8497 -5.8563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 13.9730 -3.3289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 18.1649 -2.9179 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 19.5006 -2.9179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 20.1992 -1.7672 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 15.2059 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0.0000 -1.7877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 1.1713 -1.1302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 2.3220 -1.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 3.5138 -1.1507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 4.6645 -1.8494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 5.8358 -1.1918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 7.0070 -1.8905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 8.1783 -1.2329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 9.3290 -1.9316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 10.5208 -1.2740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 11.6716 -1.9521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 12.8428 -1.3151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 13.9935 -1.9932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 15.1648 -1.3357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 16.3361 -2.0343 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 17.4868 -4.0686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 17.4457 -5.4248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 16.3155 -3.3700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 16.2744 -6.0618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 15.1237 -4.0275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 15.1237 -5.3837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 18.6375 -4.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 19.7882 -5.4454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 19.8088 -4.1097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 18.1033 -6.5961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 13.4387 -7.1303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 14.1785 -8.2605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 15.5347 -8.3838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 16.4594 -7.4180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 16.0073 -9.6373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 17.3224 -9.8633 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 11.6716 -5.8563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 12.6168 -8.1989 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 1 9 1 6 2 12 1 0 3 5 2 0 4 46 1 0 5 40 1 0 5 46 1 0 6 9 1 0 6 46 2 0 33 7 1 1 35 8 1 6 9 35 1 0 9 40 1 0 10 34 1 6 11 12 1 0 30 11 1 6 12 13 2 0 14 28 2 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 27 28 1 0 28 29 1 0 32 29 1 1 30 31 1 0 30 32 1 0 30 36 1 0 31 33 1 0 31 36 1 0 31 39 1 6 32 34 1 0 33 35 1 0 33 43 1 0 34 35 1 0 36 37 1 0 36 38 1 0 40 41 1 0 40 47 1 1 41 42 1 0 42 43 2 0 42 44 1 0 44 45 1 0 M END > InChI=1S/C36H56O8/c1-7-8-9-10-11-12-13-14-15-16-17-18-29(39)43-32-24(3)35(42)27(30-33(5,6)36(30,32)44-25(4)38)20-26(22-37)21-34(41)28(35)19-23(2)31(34)40/h19-20,24,27-28,30,32,37,41-42H,7-18,21-22H2,1-6H3/t24?,27-,28?,30+,32+,34+,35+,36+/m0/s1 > PHEDXBVPIONUQT-AOWVHHMZSA-N > 1/0/N:15,4,10,2,37,38,16,17,18,19,20,21,22,23,24,25,26,27,6,43,41,44,46,34,12,42,33,9,28,31,5,32,36,40,35,30,45,13,14,3,47,8,29,11/E:(5,6)/it:im/rA:47cHCOCCCHOCCOCOOCCCCCCCCCCCCCCOCCCCCCCCCHCCCCCOCO/rB:;;;d3;;;;N1s6;;;s2s11;d12;;;s15;s16;s17;s18;s19;s20;s21;s22;s23;s24;s25;s26;d14s27;s28;n11;s30;p29s30;p7s31;N10s32;n8s9s33s34;s30s31;s36;s36;N31;s5s9;s40;s41;s33d42;s42;s44;s4s5d6;P40;/rC:14.4251,-6.3906,0;20.5485,-3.1645,0;11.3017,-8.24,0;10.3976,-5.4454,0;12.0825,-7.1303,0;12.7606,-5.0755,0;17.5279,-6.555,0;14.0963,-4.5001,0;13.8497,-5.8563,0;13.973,-3.3289,0;18.1649,-2.9179,0;19.5006,-2.9179,0;20.1992,-1.7672,0;15.2059,0,0;0,-1.7877,0;1.1713,-1.1302,0;2.322,-1.8083,0;3.5138,-1.1507,0;4.6645,-1.8494,0;5.8358,-1.1918,0;7.007,-1.8905,0;8.1783,-1.2329,0;9.329,-1.9316,0;10.5208,-1.274,0;11.6716,-1.9521,0;12.8428,-1.3151,0;13.9935,-1.9932,0;15.1648,-1.3357,0;16.3361,-2.0343,0;17.4868,-4.0686,0;17.4457,-5.4248,0;16.3155,-3.37,0;16.2744,-6.0618,0;15.1237,-4.0275,0;15.1237,-5.3837,0;18.6375,-4.7673,0;19.7882,-5.4454,0;19.8088,-4.1097,0;18.1033,-6.5961,0;13.4387,-7.1303,0;14.1785,-8.2605,0;15.5347,-8.3838,0;16.4594,-7.418,0;16.0073,-9.6373,0;17.3224,-9.8633,0;11.6716,-5.8563,0;12.6168,-8.1989,0; > Some stereo removed > C36 H56 O8 > 616.8251 > [H]C12[C@](O)(CC(CO)=C[C@@]3([C@@]1(C([C@H]([C@]1(C(C)(C)[C@]13[H])OC(=O)C)OC(CCCCCCCCCCCCC)=O)C)O)[H])C(C(=C2)C)=O > 17215855 $$$$