62 68 0 0001 0 0 0 0 0999 V2000 14.0660 -4.4660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 11.9660 -4.7990 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 11.5330 -5.2330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 10.4000 -5.2660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 12.7000 -1.1660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 9.6330 -1.0660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 11.4660 -1.0660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 7.5660 -4.8330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 13.2000 -6.0330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 9.9330 -5.8990 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 8.0660 -1.7660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 6.6660 -3.3330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 5.8330 -5.8330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 3.2660 -3.3330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 4.9660 -3.3330 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 11.8660 -3.5990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 12.7000 -4.0990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 11.8330 -2.6330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 13.5660 -3.5990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 11.1330 -4.3330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 10.1330 -4.3330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 12.7000 -2.1330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 13.5660 -2.6330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 10.1330 -3.3330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 13.2000 -4.9660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 11.1000 -1.9660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 9.2660 -4.8330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 9.2660 -2.8330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 12.6660 -3.1330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 10.0330 -1.9660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 8.4000 -4.3330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 8.4000 -3.3330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 10.4660 -2.3990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 11.1000 -3.4660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 7.5330 -2.8330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 12.2330 -5.7660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 10.9000 -6.0330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 11.5660 -6.4660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 8.6330 -0.9660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 6.7000 -4.3330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 11.6000 -7.6330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 5.8330 -4.8330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 8.2330 -0.0660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 10.9660 -8.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 12.5660 -7.7660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 4.9660 -4.3330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 11.3660 -9.3330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 12.9330 -8.6660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 12.3000 -9.4660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 4.1330 -4.8330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 3.2660 -4.3330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 4.1330 -5.8330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 4.1330 -2.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 2.4000 -4.8330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 3.2660 -6.3330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 4.1000 -1.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 2.3660 -5.8330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 3.2330 -1.3660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 4.9660 -1.3660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 3.2330 -0.3990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 4.9330 -0.3660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 4.1000 0.1000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 1 25 1 0 2 17 1 0 2 36 1 0 3 20 1 0 3 37 1 0 21 4 1 1 22 5 1 1 30 6 1 1 6 39 1 0 7 26 2 0 31 8 1 6 8 40 1 0 9 36 2 0 10 37 2 0 11 39 2 0 12 40 2 0 13 42 1 0 14 53 2 0 15 46 1 0 15 53 1 0 16 17 1 0 16 18 1 0 16 20 1 0 17 19 1 0 17 25 1 0 18 22 1 0 18 26 1 0 18 29 1 1 19 23 1 0 20 21 1 0 21 24 1 0 21 27 1 0 22 23 1 0 24 28 1 0 24 33 1 0 24 34 1 0 26 30 1 0 27 31 1 0 28 30 1 0 28 32 2 0 31 32 1 0 32 35 1 0 36 38 1 0 37 41 1 0 39 43 1 0 40 42 1 0 41 44 2 0 41 45 1 0 42 46 1 0 44 47 1 0 45 48 2 0 46 50 1 0 47 49 2 0 48 49 1 0 50 51 2 0 50 52 1 0 51 54 1 0 52 55 2 0 53 56 1 0 54 57 2 0 55 57 1 0 56 58 2 0 56 59 1 0 58 60 1 0 59 61 2 0 60 62 2 0 61 62 1 0 M END > InChI=1S/C47H51NO14/c1-25-31(60-43(56)36(52)35(28-16-10-7-11-17-28)48-41(54)29-18-12-8-13-19-29)23-47(57)40(61-42(55)30-20-14-9-15-21-30)38-45(6,32(51)22-33-46(38,24-58-33)62-27(3)50)39(53)37(59-26(2)49)34(25)44(47,4)5/h7-21,31-33,35-38,40,51-52,57H,22-24H2,1-6H3,(H,48,54)/t31-,32-,33?,35?,36?,37+,38?,40?,45+,46?,47+/m0/s1 > RCINICONZNJXQF-PZZLNDKRSA-N > 1/1/N:35,43,38,33,34,29,57,62,49,54,55,60,61,47,48,51,52,58,59,44,45,23,27,25,32,39,36,50,56,41,31,22,19,28,46,42,30,16,26,20,53,37,40,24,18,17,21,15,11,9,5,13,7,14,10,12,4,1,6,8,3,2/E:(4,5)(10,11)(12,13)(14,15)(16,17)(18,19)(20,21)/it:im/rA:62nOOOOOOOOOOOOOONCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC/rB:;;;;;;;;;;;;;;;s2s16;s16;s1s17;s3s16;p4s20;p5s18;s19s22;s21;s1s17;d7s18;s21;s24;P18;p6s26s28;n8s27;d28s31;s24;s24;s32;s2d9;s3d10;s36;s6d11;s8d12;s37;s13s40;s39;d41;s41;s15s42;s44;d45;d47s48;s46;d50;s50;d14s15;s51;d52;s53;d54s55;d56;s56;s58;d59;d60s61;/rC:14.066,-4.466,0;11.966,-4.799,0;11.533,-5.233,0;10.4,-5.266,0;12.7,-1.166,0;9.633,-1.066,0;11.466,-1.066,0;7.566,-4.833,0;13.2,-6.033,0;9.933,-5.899,0;8.066,-1.766,0;6.666,-3.333,0;5.833,-5.833,0;3.266,-3.333,0;4.966,-3.333,0;11.866,-3.599,0;12.7,-4.099,0;11.833,-2.633,0;13.566,-3.599,0;11.133,-4.333,0;10.133,-4.333,0;12.7,-2.133,0;13.566,-2.633,0;10.133,-3.333,0;13.2,-4.966,0;11.1,-1.966,0;9.266,-4.833,0;9.266,-2.833,0;12.666,-3.133,0;10.033,-1.966,0;8.4,-4.333,0;8.4,-3.333,0;10.466,-2.399,0;11.1,-3.466,0;7.533,-2.833,0;12.233,-5.766,0;10.9,-6.033,0;11.566,-6.466,0;8.633,-.966,0;6.7,-4.333,0;11.6,-7.633,0;5.833,-4.833,0;8.233,-.066,0;10.966,-8.433,0;12.566,-7.766,0;4.966,-4.333,0;11.366,-9.333,0;12.933,-8.666,0;12.3,-9.466,0;4.133,-4.833,0;3.266,-4.333,0;4.133,-5.833,0;4.133,-2.866,0;2.4,-4.833,0;3.266,-6.333,0;4.1,-1.866,0;2.366,-5.833,0;3.233,-1.366,0;4.966,-1.366,0;3.233,-.399,0;4.933,-.366,0;4.1,.1,0; > C47 H51 N O14 > 853.9061 > O1CC2(C1C[C@@H]([C@@]1(C)C([C@@H](C3=C(C)[C@H](C[C@](C3(C)C)(C(C21)OC(C1C=CC=CC=1)=O)O)OC(C(C(C1C=CC=CC=1)NC(C1C=CC=CC=1)=O)O)=O)OC(C)=O)=O)O)OC(C)=O |&1:5,6,9,13,15| > 4479385 $$$$