RInChI=1.00.1S/C20H20N2O8S/c1-10(23)29-8-13-9-31-19-14(18(26)22(19)15(13)20(27)28)21-17(25)16(30-11(2)24)12-6-4-3-5-7-12/h3-7,14,16,19H,8-9H2,1-2H3,(H,21,25)(H,27,28)<>C8H10N2O3S/c1-3-2-14-7-4(9)6(11)10(7)5(3)8(12)13/h4,7H,2,9H2,1H3,(H,12,13)<>H2O/h1H2/d+
RAuxInfo=1.00.1/1/N:1,15,20,19,21,18,22,4,6,2,14,17,5,9,27,12,11,24,8,28,10,26,31,16,23,25,29,30,3,13,7/E:(4,5)(6,7)(27,28)/rA:31nCCOCCCSCCNCCOCCOCCCCCCOCONCCOOO/rB:s1;s2;s3;s4;s5;s6;s7;s8;s9;s10;s11;s12;s13;s14;d14;s12;s17;d18;s19;d20;d17s21;d11;s9;d24;s8s24;d5s26;s27;s28;d28;d2;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;<>1/N:1,3,2,6,11,8,5,12,7,10,9,13,14,4/E:(12,13)/rA:14nCCCSCCNCONCCOO/rB:s1;s2;s3;s4;s5;s6;s6;d8;s5s8;d2s10;s11;s12;d12;/rC:;;;;;;;;;;;;;;<>0/N:1/rA:1nO/rB:/rC:;
Long-RInChIKey=SA-FUHFF-XRVPSMBZQKYMGA-UHFFFAOYSA-N--NVIAYEIXYQCDAN-UHFFFAOYSA-N--XLYOFNOQVPJJNP-UHFFFAOYSA-N
Short-RInChIKey=SA-FUHFF-XRVPSMBZQK-NVIAYEIXYQ-XLYOFNOQVP-NUHFF-NUHFF-NUHFF-ZZZ
Web-RInChIKey=DEQXOIGUEKAJMSFJR-NUHFFFADPSCTJSA