RInChI=1.00.1S/C22H24N4O4/c1-4-26(5-2)21(27)15-6-8-18(9-7-15)30-22-24-14-19(23)20(25-22)29-17-12-10-16(28-3)11-13-17/h6-14H,4-5,23H2,1-3H3!C2H4O2/c1-2(3)4/h1H3,(H,3,4)!CH3BN.Na/c2-1-3;/h2H3;/q-1;+1<>C32H41N5O6/c1-7-36(8-2)29(38)22-11-13-26(14-12-22)42-30-34-21-27(28(35-30)41-25-17-15-24(40-6)16-18-25)33-20-23-10-9-19-37(23)31(39)43-32(3,4)5/h11-18,21,23,33H,7-10,19-20H2,1-6H3<>CH4O/c1-2/h2H,1H3/d+
RAuxInfo=1.00.1/0/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/E:(1,2)(4,5)(6,7)(8,9)(10,11)(12,13)/rA:30CCCCCCCCCCCCCCCCCCCCCCNNNNOOOO/rB:;;s1;s2;;;s6;d7;;;s10;d11;;d6s7;d10s11;d12s13;d8s9;d14;s19;s15;;s19;s14d22;d20s22;s4s5s21;d21;s3s16;s17s20;s18s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;!1/N:1,2,3,4/E:(3,4)/rA:4CCOO/rB:s1;d2;s2;/rC:;;;;!0/N:1,2,3;4/CRV:2-1;/rA:4CB-NNa+/rB:s1;t1;;/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/E:(1,2)(3,4,5)(7,8)(11,12)(13,14)(15,16)(17,18)/rA:43CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCNNNNNOOOOOO/rB:;;;;;s1;s2;;s9;;;s11;d12;;;s15;d16;s9;;;d11s12;s10s20;d15s16;d17s18;d13s14;d21;s27;s22;;;s3s4s5;s20s27;s21d30;d28s30;s7s8s29;s19s23s31;d29;d31;s6s24;s25s28;s26s30;s31s32;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;<>0/N:1,2/rA:2CO/rB:s1;/rC:;;
Long-RInChIKey=SA-FUHFF-SKIOUGPGZAASDR-UHFFFAOYSA-N-QTBSBXVTEAMEQO-UHFFFAOYSA-N-CVDUGUOQTVTBJH-UHFFFAOYSA-N--SRKPJQLNDUDPLA-UHFFFAOYSA-N--OKKJLVBELUTLKV-UHFFFAOYSA-N
Short-RInChIKey=SA-FUHFF-HKMBYOFRRF-SRKPJQLNDU-OKKJLVBELU-NUHFF-NUHFF-NUHFF-ZZZ
Web-RInChIKey=ACADOIYAEOMNQTLLL-NUHFFFADPSCTJSA