RInChI=0.03.1S/C19H25N7OS2/c1-18(2)13(5-6-19(18,3)21)23-14-11(15(20)27)8-22-26-9-10(7-12(14)26)16-24-25-17(28-4)29-16/h7-9,13,23H,5-6,21H2,1-4H3,(H2,20,27)<>C24H35N7O4S2/c1-22(2,3)35-20(34)28-24(6)9-8-16(23(24,4)5)27-17-14(18(25)32)11-26-31-12-13(10-15(17)31)19(33)29-30-21(36)37-7/h10-12,16,27H,8-9H2,1-7H3,(H2,25,32)(H,28,34)(H,29,33)(H,30,36)!C7H8O3S.H2O/c1-6-2-4-7(5-3-6)11(8,9)10;/h2-5H,1H3,(H,8,9,10);1H2<>C2H6O/c1-2-3/h3H,2H2,1H3/d-

RAuxInfo=0.03.1/1/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/E:(1,2)/rA:29CCCCCCCCCCCCCCCCCCCNNNNNNNOSS/rB:;;;;s5;;;;s7d9;s8;d7;s5;d11s12;s11;s10;;s1s2s13;s3s6s18;d15;s19;d8;s13s14;d16;d17s24;s9s12s22;s15;s4s17;s16s17;/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/E:(1,2,3)(4,5)/rA:37CCCCCCCCCCCCCCCCCCCCCCCCNNNNNNNOOOOSS/rB:;;;;;;;s8;;;;s10d12;s11;d10;s8;d14s15;s14;s13;;;s1s2s3;s4s5s16;s6s9s23;d18;d11;s16s17;d20s24;d19;d21s29;s12s15s26;s18;s19;s20;s20s22;s21;s7s21;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;!1/N:1,2,3,4,5,6,7,8,9,10,11;12/E:(2,3)(4,5)(8,9,10);/CRV:11.6;/rA:12CCCCCCCOOOSO/rB:;;s2;d3;s1d2s3;d4s5;;;;s7s8d9d10;;/rC:;;;;;;;;;;;;<>0/N:1,2,3/rA:3CCO/rB:s1;s2;/rC:;;;

Long-RInChIKey=SA-BUHFF-RZZZRLWCLDKDIB-UHFFFAOYSA-N--BSUNKSNFEKVKOV-UHFFFAOYSA-N-KJIFKLIQANRMOU-UHFFFAOYSA-N--LFQSCWFLJHTTHZ-UHFFFAOYSA-N

Short-RInChIKey=SA-BUHFF-RZZZRLWCLD-JKONIONAOX-LFQSCWFLJH-NUHFF-NUHFF-NUHFF-ZZZ

Web-RInChIKey=GEXBPAZDHHTURWHUR-NUHFFFADPSCTJSA