RInChI=1.00.1S/C10H16BN3O2/c1-9(2)10(3,4)16-11(15-9)7-5-13-8(12)14-6-7/h5-6H,1-4H3,(H2,12,13,14)!C11H13ClN4O3/c1-15-7(17)6-19-8-9(15)13-11(12)14-10(8)16-2-4-18-5-3-16/h2-6H2,1H3!CH2O3.2Na/c2-1(3)4;;/h(H2,2,3,4);;/q;2*+1/p-2<>C15H17N7O3/c1-21-10(23)8-25-11-13(21)19-12(9-6-17-15(16)18-7-9)20-14(11)22-2-4-24-5-3-22/h6-7H,2-5,8H2,1H3,(H2,16,17,18)<>2C18H15P.2ClH.Pd/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;;;/h2*1-15H;2*1H;/q;;;;+2/p-2!C2H3N/c1-2-3/h1H3/d+
RAuxInfo=1.00.1/1/N:1,2,3,4,5,6,7,8,9,10,11,12,13,14,15,16/E:(1,2,3,4)(5,6)(9,10)(13,14)(15,16)/rA:16CCCCCCCCCCBNNNOO/rB:;;;;;d5s6;;s1s2;s3s4s9;s7;d8;s5s8;d6s8;s9s11;s10s11;/rC:;;;;;;;;;;;;;;;;!0/N:1,2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18,19/E:(2,3)(4,5)/rA:19CCCCCCCCCCCClNNNNOOO/rB:;;s2;s3;;s6;;d8;s8;;s11;s9d11;d10s11;s1s7s9;s2s3s10;d7;s4s5;s6s8;/rC:;;;;;;;;;;;;;;;;;;;!1/N:1,2,3,4;5;6/E:(2,3,4);;/rA:6COO-O-Na+Na+/rB:d1;s1;s1;;;/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/E:(2,3)(4,5)(6,7)(17,18)/rA:25CCCCCCCCCCCCCCCNNNNNNNOOO/rB:;;s2;s3;;;;d6s7;s8;;s9;d11;s11;;d15;s6s15;d7s15;d12s13;s12d14;s1s10s13;s2s3s14;d10;s4s5;s8s11;/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/E:2*(1,2,3)(4,5,6,7,8,9)(10,11,12,13,14,15)(16,17,18);;;/rA:41CCCCCCCCCCCCCCCCCCPCCCCCCCCCCCCCCCCCCPCl-Cl-Pd+2/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;;;;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;!0/N:1,2,3/rA:3CCN/rB:s1;t2;/rC:;;;
Long-RInChIKey=SA-FUHFF-BPQVMIDUTRJYSC-UHFFFAOYSA-N-NCIABRNVYPXRNY-UHFFFAOYSA-N-CDBYLPFSWZWCQE-UHFFFAOYSA-L--HQLLYMXCQJCBDC-UHFFFAOYSA-N--YNHIGQDRGKUECZ-UHFFFAOYSA-L-WEVYAHXRMPXWCK-UHFFFAOYSA-N
Short-RInChIKey=SA-FUHFF-UWTGRJLXTG-HQLLYMXCQJ-UPPRHHPHBI-LUHFF-NUHFF-LUHFF-ZZZ
Web-RInChIKey=FWWDVIMIJGEUHUSYE-JUHFFFADPSCTJSA