58 65 0 0001 0 0 0 0 0999 V2000 18.3025 -4.9916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 18.3025 -6.2937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 16.0599 -6.2937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 17.1450 -6.9448 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 14.9024 -6.9448 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 19.3876 -4.3405 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 17.1450 -4.3405 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 19.3876 -3.0384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 18.7365 -1.0851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 16.0599 -4.9916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 20.5451 -6.2937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 20.0387 -1.0851 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 20.5451 -4.9916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 17.1450 -8.2470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 18.3748 -2.3149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 14.9024 -8.2470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 20.4727 -2.3149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 18.0131 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 16.0599 -8.8980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 18.3025 -3.6894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 14.9024 -5.6427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 13.8173 -6.2937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 13.8173 -8.8980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 12.6598 -6.9448 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 12.6598 -8.2470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 16.0599 -7.5959 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 17.1450 -5.6427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 20.5451 -3.6894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 11.5023 -8.8980 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 10.3449 -8.2470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 9.1874 -8.8980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 8.0299 -8.2470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 6.8725 -8.9704 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 8.0299 -6.9448 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 6.8725 -6.2937 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 9.1874 -6.2937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 10.3449 -6.9448 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 9.1874 -4.9192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 5.7150 -6.9448 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 5.7150 -8.3193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 4.5575 -8.9704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 4.5575 -10.3449 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 3.4001 -8.3193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 2.3149 -8.9704 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 3.4001 -7.0171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 4.5575 -6.2937 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 2.2426 -6.3661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 2.2426 -10.3449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 3.4001 -10.9959 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 3.4001 -12.3704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 4.6299 -13.0215 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 2.3149 -13.0215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 2.3149 -14.3237 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 1.1575 -12.3704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 1.1575 -10.9959 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0.0000 -13.0215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 18.3025 -7.5959 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 21.7025 -4.3405 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 1 6 1 0 1 7 1 0 1 20 1 1 1 2 1 0 2 11 1 0 2 4 1 0 2 57 1 1 3 4 1 0 3 26 1 6 3 10 1 0 3 5 1 0 4 14 1 0 4 27 1 1 5 16 1 0 5 21 1 1 5 22 1 0 6 8 1 0 6 13 1 0 6 28 1 6 7 10 1 0 8 15 2 0 8 17 1 0 9 15 1 0 9 18 2 0 9 12 1 0 11 13 1 0 12 17 1 0 13 58 1 0 14 19 1 0 16 23 1 0 16 19 1 0 22 24 1 0 23 25 1 0 24 25 1 0 25 29 1 0 30 29 1 1 30 31 1 0 30 37 1 0 31 32 1 0 32 33 1 6 32 34 1 0 34 35 1 6 34 36 1 0 39 35 1 1 36 37 1 0 36 38 1 1 39 40 1 0 39 46 1 0 40 41 1 0 41 42 1 6 41 43 1 0 43 44 1 6 43 45 1 0 48 44 1 1 45 46 1 0 45 47 1 1 48 49 1 0 48 55 1 0 49 50 1 0 50 51 1 6 50 52 1 0 52 53 1 6 52 54 1 0 54 55 1 0 54 56 1 1 M END > InChI=1S/C41H64O14/c1-19-36(47)27(42)14-33(50-19)54-38-21(3)52-34(16-29(38)44)55-37-20(2)51-32(15-28(37)43)53-24-8-10-39(4)23(13-24)6-7-26-25(39)9-11-40(5)35(22-12-31(46)49-18-22)30(45)17-41(26,40)48/h12,19-21,23-30,32-38,42-45,47-48H,6-11,13-18H2,1-5H3/t19-,20-,21-,23?,24?,25+,26-,27+,28+,29+,30?,32+,33+,34+,35+,36-,37-,38-,39+,40-,41+/m1/s1 > LKRDZKPBAOKJBT-MJIKFHMVSA-N > 1/0/N:56,38,47,21,20,19,14,24,10,22,7,15,23,49,31,40,11,17,54,36,45,8,16,25,3,4,50,32,41,13,9,30,48,39,6,52,34,43,5,1,2,51,33,42,58,18,53,57,12,55,37,46,29,44,35/it:im/rA:58cCCCCCCCCCCCOCCCCCOCCCCCCCHHHOCCCOCOCOCCCCOCOCOCCCCOCOCOCOO/rB:s1;;s2s3;s3;s1;s1;s6;;s3s7;s2;s9;s6s11;s4;d8s9;s5;s8s12;d9;s14s16;P1;P5;s5;s16;s22;s23s24;N3;P4;N6;s25;p29;s30;s31;N32;s32;N34;s34;s30s36;P36;p35;s39;s40;N41;s41;N43;s43;s39s45;P45;p44;s48;s49;N50;s50;N52;s52;s48s54;P54;P2;s13;/rC:18.3025,-4.9916,0;18.3025,-6.2937,0;16.0599,-6.2937,0;17.145,-6.9448,0;14.9024,-6.9448,0;19.3876,-4.3405,0;17.145,-4.3405,0;19.3876,-3.0384,0;18.7365,-1.0851,0;16.0599,-4.9916,0;20.5451,-6.2937,0;20.0387,-1.0851,0;20.5451,-4.9916,0;17.145,-8.247,0;18.3748,-2.3149,0;14.9024,-8.247,0;20.4727,-2.3149,0;18.0131,0,0;16.0599,-8.898,0;18.3025,-3.6894,0;14.9024,-5.6427,0;13.8173,-6.2937,0;13.8173,-8.898,0;12.6598,-6.9448,0;12.6598,-8.247,0;16.0599,-7.5959,0;17.145,-5.6427,0;20.5451,-3.6894,0;11.5023,-8.898,0;10.3449,-8.247,0;9.1874,-8.898,0;8.0299,-8.247,0;6.8725,-8.9704,0;8.0299,-6.9448,0;6.8725,-6.2937,0;9.1874,-6.2937,0;10.3449,-6.9448,0;9.1874,-4.9192,0;5.715,-6.9448,0;5.715,-8.3193,0;4.5575,-8.9704,0;4.5575,-10.3449,0;3.4001,-8.3193,0;2.3149,-8.9704,0;3.4001,-7.0171,0;4.5575,-6.2937,0;2.2426,-6.3661,0;2.2426,-10.3449,0;3.4001,-10.9959,0;3.4001,-12.3704,0;4.6299,-13.0215,0;2.3149,-13.0215,0;2.3149,-14.3237,0;1.1575,-12.3704,0;1.1575,-10.9959,0;0,-13.0215,0;18.3025,-7.5959,0;21.7025,-4.3405,0; > C41 H64 O14 > 780.9385 > [C@]12([C@@](O)([C@]3([H])CCC4CC(O[C@@H]5O[C@H](C)[C@@H](O[C@@H]6O[C@H](C)[C@@H](O[C@@H]7O[C@H](C)[C@@H](O)[C@@H](O)C7)[C@@H](O)C6)[C@@H](O)C5)CC[C@]4(C)[C@]3(CC1)[H])CC(O)[C@]2([H])C1COC(=O)C=1)C > 16739939 $$$$