RInChI=1.00.1S/3K.H3O4P/c;;;1-5(2,3)4/h;;;(H3,1,2,3,4)/q3*+1;/p-3!C11H12BrN7/c1-6-17-8(7-4-15-18(3)10(7)12)9-11(13-2)14-5-16-19(6)9/h4-5H,1-3H3,(H,13,14,16)!C13H17BF2O2/c1-12(2)13(3,4)18-14(17-12)10-7-5-9(6-8-10)11(15)16/h5-8,11H,1-4H3!ClH/h1H!Na.H2O/h;1H2/q+1;/p-1<>C18H17F2N7/c1-10-25-14(16-18(21-2)22-9-24-27(10)16)13-8-23-26(3)15(13)11-4-6-12(7-5-11)17(19)20/h4-9,17H,1-3H3,(H,21,22,24)<>4C18H15P.Pd/c4*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;/h4*1-15H;!C2H6O/c1-2-3/h3H,2H2,1H3!H2O/h1H2/d+
RAuxInfo=1.00.1/1/N:1;2;3;4,5,6,7,8/E:;;;(1,2,3,4)/rA:8K+K+K+O-O-O-OP/rB:;;;;;;s4s5s6d7;/rC:;;;;;;;;!1/N:1,2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18,19/rA:19CCCCCCCCCCCBrNNNNNNN/rB:;;;;s1;s4;s7;d8;d7;s9;s10;s2d11;d5s11;d4;s5;d6s8;s3s10s15;s6s9s16;/rC:;;;;;;;;;;;;;;;;;;;!0/N:1,2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18/E:(1,2,3,4)(5,6)(7,8)(12,13)(15,16)(17,18)/rA:18CCCCCCCCCCCCCBFFOO/rB:;;;;;s5;d6;d5s6;d7s8;s9;s1s2;s3s4s12;s10;s11;s11;s12s14;s13s14;/rC:;;;;;;;;;;;;;;;;;;!0/N:1/rA:1Cl/rB:/rC:;!1/N:1;2/rA:2Na+O-/rB:;/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/E:(4,5)(6,7)(19,20)/rA:27CCCCCCCCCCCCCCCCCCFFNNNNNNN/rB:;;;;s4;d5;;;s1;d4s5;d6s7;s8;s13;s11d13;d14;s12;s16;s17;s17;s2d18;d9s18;d8;s9;d10s14;s3s15s23;s10s16s24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;<>0/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;39,40,41,42,43,44,45,46,47,48,49,50,51,52,53,54,55,56,57;58,59,60,61,62,63,64,65,66,67,68,69,70,71,72,73,74,75,76;77/E:4*(1,2,3)(4,5,6,7,8,9)(10,11,12,13,14,15)(16,17,18);/rA:77CCCCCCCCCCCCCCCCCCPCCCCCCCCCCCCCCCCCCPCCCCCCCCCCCCCCCCCCPCCCCCCCCCCCCCCCCCCPPd/rB:;;d1;s1;d2;s2;d3;s3;s4;d5;s6;d7;s8;d9;d10s11;d12s13;d14s15;s16s17s18;;;;d20;s20;d21;s21;d22;s22;s23;d24;s25;d26;s27;d28;d29s30;d31s32;d33s34;s35s36s37;;;;d39;s39;d40;s40;d41;s41;s42;d43;s44;d45;s46;d47;d48s49;d50s51;d52s53;s54s55s56;;;;d58;s58;d59;s59;d60;s60;s61;d62;s63;d64;s65;d66;d67s68;d69s70;d71s72;s73s74s75;;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;!0/N:1,2,3/rA:3CCO/rB:s1;s2;/rC:;;;!0/N:1/rA:1O/rB:/rC:;
Long-RInChIKey=SA-FUHFF-LWIHDJKSTIGBAC-UHFFFAOYSA-K-YWLUXCCLWJKQIV-UHFFFAOYSA-N-XOIBKPJPWFARFO-UHFFFAOYSA-N-VEXZGXHMUGYJMC-UHFFFAOYSA-N-HEMHJVSKTPXQMS-UHFFFAOYSA-M--OOUPWINPOLVODI-UHFFFAOYSA-N--NFHFRUOZVGFOOS-UHFFFAOYSA-N-LFQSCWFLJHTTHZ-UHFFFAOYSA-N-XLYOFNOQVPJJNP-UHFFFAOYSA-N
Short-RInChIKey=SA-FUHFF-WMGLPDYOHO-OOUPWINPOL-XSZCEGBXBU-JUHFF-NUHFF-NUHFF-ZZZ
Web-RInChIKey=JRBNAVJXCBSUSIYKT-JUHFFFADPSCTJSA