RInChI=1.00.1S/C37H48N4O5.C6H12/c1-25(2)34(41-20-12-19-38-37(41)45)36(44)39-30(21-28-15-7-5-8-16-28)23-32(42)31(22-29-17-9-6-10-18-29)40-33(43)24-46-35-26(3)13-11-14-27(35)4;1-2-4-6-5-3-1/h5-11,13-18,25,30-32,34,42H,12,19-24H2,1-4H3,(H,38,45)(H,39,44)(H,40,43);1-6H2<>C37H48N4O5/c1-25(2)34(41-20-12-19-38-37(41)45)36(44)39-30(21-28-15-7-5-8-16-28)23-32(42)31(22-29-17-9-6-10-18-29)40-33(43)24-46-35-26(3)13-11-14-27(35)4/h5-11,13-18,25,30-32,34,42H,12,19-24H2,1-4H3,(H,38,45)(H,39,44)(H,40,43)<>C2H6O/c1-2-3/h3H,2H2,1H3!C37H48N6O5S2/c1-24(2)33(42-36(46)43(5)20-29-22-49-35(40-29)25(3)4)34(45)39-28(16-26-12-8-6-9-13-26)18-32(44)31(17-27-14-10-7-11-15-27)41-37(47)48-21-30-19-38-23-50-30/h6-15,19,22-25,28,31-33,44H,16-18,20-21H2,1-5H3,(H,39,45)(H,41,47)(H,42,46)/d+
RAuxInfo=1.00.1/1/N:1,2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18,19,20,21,22,23,24,25,26,27,28,29,30,31,32,33,34,35,36,37,38,39,40,41,42,43,44,45,46;47,48,49,50,51,52/E:(1,2)(3,4)(7,8)(9,10)(13,14)(15,16)(17,18)(26,27);(1,2,3,4,5,6)/rA:52CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCNNNNOOOOOCCCCCC/rB:;;;;;d5;s5;d6;s6;;;d11;s11;s7;d8;s9;d10;s12;s12;;;;;s1s2;s3s13;s4d14;d15s16s21;d17s18s22;s21s23;s22;s23s31;s24;s25;d26s27;s34;;s19d37;s30d36;s31d33;s20s34s37;s32;s33;s36;s37;s24s35;;s47;s47;s48;s49;s50s51;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;<>1/N:1,2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18,19,20,21,22,23,24,25,26,27,28,29,30,31,32,33,34,35,36,37,38,39,40,41,42,43,44,45,46/E:(1,2)(3,4)(7,8)(9,10)(13,14)(15,16)(17,18)(26,27)/rA:46CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCNNNNOOOOO/rB:;;;;;d5;s5;d6;s6;;;d11;s11;s7;d8;s9;d10;s12;s12;;;;;s1s2;s3s13;s4d14;d15s16s21;d17s18s22;s21s23;s22;s23s31;s24;s25;d26s27;s34;;s19d37;s30d36;s31d33;s20s34s37;s32;s33;s36;s37;s24s35;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;<>0/N:1,2,3/rA:3CCO/rB:s1;s2;/rC:;;;!1/N:1,2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18,19,20,21,22,23,24,25,26,27,28,29,30,31,32,33,34,35,36,37,38,39,40,41,42,43,44,45,46,47,48,49,50/E:(1,2)(3,4)(8,9)(10,11)(12,13)(14,15)/rA:50CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCNNNNNNOOOOOSS/rB:;;;;;;d6;s6;d7;s7;s8;d9;s10;d11;;;;;;;;;s1s2;s3s4;d12s13s16;d14s15s17;s16s18;s20d22;d19s21;s17;s18s31;s24;s33;s25;;;s19d23;s28d34;s29d35;s31d37;s33d36;s5s20s36;s32;s34;s36;s37;s21s37;s22s35;s23s30;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;
Long-RInChIKey=SA-FUHFF-BCZCRIAIKDOGHV-UHFFFAOYSA-N--KJHKTHWMRKYKJE-UHFFFAOYSA-N--LFQSCWFLJHTTHZ-UHFFFAOYSA-N-NCDNCNXCDXHOMX-UHFFFAOYSA-N
Short-RInChIKey=SA-FUHFF-BCZCRIAIKD-KJHKTHWMRK-CCSOVHDLCY-NUHFF-NUHFF-NUHFF-ZZZ
Web-RInChIKey=AMHKREYKSZSUCTURA-NUHFFFADPSCTJSA