InChI |
InChI=1S/C77H98O30/c1-34-12-10-14-44-20-40(32-100-69-59(90)57(88)55(86)47(30-80)102-69)36(3)21-74(44)61(92)49(65(96)104-74)45(82)15-18-72(8)25-41(28-78)38(5)23-77(72)64(95)52(68(99)107-77)54(85)35(2)13-11-17-71(7)27-43(33-101-70-60(91)58(89)56(87)48(31-81)103-70)39(6)24-75(71)62(93)50(66(97)105-75)46(83)16-19-73(9)26-42(29-79)37(4)22-76(73)63(94)51(53(34)84)67(98)106-76/h10-20,25-29,36-39,44-60,65-70,80-91H,21-24,30-33H2,1-9H3/q-4/b14-10-,17-11?,18-15-,19-16-,34-12-,35-13-/t36?,37?,38?,39?,44?,45?,46?,47-,48-,49?,50?,51?,52?,53?,54?,55+,56+,57+,58+,59-,60-,65?,66?,67?,68?,69+,70+,71?,72?,73?,74?,75?,76?,77?/m1/s1AuxInfo=1/0/N:92,68,1,89,65,83,69,62,86,7,37,8,38,6,53,23,36,52,22,93,3,17,47,31,50,20,34,63,87,103,78,95,70,9,39,2,18,48,32,94,49,19,33,5,54,24,101,76,55,25,11,41,10,40,100,75,99,74,98,73,56,29,15,45,58,26,12,42,97,72,35,51,21,4,28,14,44,64,88,104,79,61,85,91,67,105,80,106,81,107,82,57,30,16,46,60,84,90,66,96,71,102,77,59,27,13,43/it:im/CRV:96-1,97-1,98-1,99-1/rA:107CCCCCCCCCCCCOCCOCCCCCCCCCCOCCOCCCCCCCCCCCCOCCOCCCCCCCCCCOCOO-OCCOCO-OCCCOC.eC.oC.eC.eC.eOCOOOOCO-OCCOCO-OCCCCOC.eC.oC.eC.eC.eOCOOOO/rB:s1;s2;s3;s4;s5;d-6;s7;d-8;s9;s10;s11;s12;s13;s11s14;d15;s14;s17;s18;d19;s14s20;s21;d?22;s23;s24;s25;s26;s27;s25s28;d29;s28;s31;s32;d33;s28s34;s35;d?36;s37;d?38;s39;s40;s41;s42;s43;s41s44;d45;s44;s47;s48;d49;s44s50;s51;d-52;s53;s54;s4s55;d56;s55;s4s58;s58;s54;s51;s49;d63;s48;s42;s40;s39;s35;s33;s70;n71;s72;s73;s74;s75;s72s76;P76;s78;P75;P74;N73;s32;s26;s24;s21;s19;d87;s18;s12;s10;s9;s5;s2d93;s94;s95;n96;s97;s98;s99;s100;s97s101;P101;s103;P100;P99;N98;/rC:6.1468,-1.536,0;7.6856,-1.4735,0;9.2875,-2.6164,0;8.0931,-2.517,0;10.0159,-1.6189,0;11.6875,-1.062,0;13.4053,-.915,0;15.1054,-1.1995,0;16.7167,-1.8035,0;18.2035,-2.6815,0;19.4751,-3.8985,0;18.3955,-4.9886,0;19.008,-6.4224,0;20.5888,-6.6577,0;20.7958,-4.9173,0;22.2156,-4.3209,0;20.0645,-7.9864,0;21.735,-8.9794,0;22.683,-7.3606,0;22.7154,-8.7357,0;20.7742,-8.5958,0;20.2515,-9.9933,0;19.657,-11.2884,0;18.8821,-12.5527,0;18.1151,-13.9079,0;18.8687,-15.2464,0;17.779,-16.3782,0;16.2279,-15.8977,0;16.5993,-14.3348,0;15.4881,-13.2685,0;14.5809,-15.6919,0;13.4361,-17.046,0;14.0156,-18.52,0;15.5384,-18.7902,0;16.2122,-17.4253,0;14.5051,-16.7642,0;12.8359,-15.6935,0;11.2967,-14.6515,0;9.9175,-13.4674,0;8.5608,-12.2918,0;7.0795,-11.2887,0;5.6315,-11.9476,0;4.4287,-10.9526,0;4.8621,-9.4239,0;6.4884,-9.772,0;7.4863,-8.5991,0;3.2264,-9.4193,0;2.2592,-8.1922,0;2.8474,-6.7772,0;4.3739,-6.621,0;5.3448,-7.882,0;6.9365,-7.7909,0;7.8872,-6.5826,0;6.4769,-5.9381,0;6.4685,-4.4448,0;7.9712,-4.0545,0;9.1512,-5.0441,0;5.5222,-3.2414,0;6.4745,-2.0623,0;3.9822,-3.2314,0;4.9885,-6.3336,0;5.985,-6.4814,0;1.9284,-5.5415,0;.3987,-5.7195,0;.7336,-8.4021,0;5.4287,-13.4742,0;9.4984,-11.0701,0;8.9116,-14.6336,0;17.7497,-17.3372,0;13.0402,-19.7117,0;13.5845,-21.1523,0;12.6091,-22.344,0;13.1534,-23.7846,0;12.178,-24.9763,0;10.6582,-24.7274,0;10.1139,-23.2868,0;11.0893,-22.0951,0;8.5942,-23.0379,0;7.6187,-24.2296,0;9.6828,-25.9191,0;12.7223,-26.4169,0;14.6732,-24.0335,0;11.9166,-16.7952,0;20.3963,-15.4411,0;17.5553,-11.7709,0;21.6059,-9.8919,0;23.0686,-5.8697,0;24.5526,-5.4582,0;22.1195,-10.4707,0;16.8828,-4.7002,0;19.1336,-1.4541,0;17.381,-.4142,0;9.605,-.0502,0;8.0626,.0566,0;7.1552,1.3009,0;7.7791,2.7088,0;6.8717,3.9531,0;5.3405,3.7895,0;4.4331,5.0338,0;5.057,6.4417,0;6.5883,6.6054,0;7.4957,5.3611,0;7.2122,8.0133,0;6.3048,9.2576,0;4.1496,7.686,0;2.9018,4.8701,0;4.7165,2.3815,0; |