ci 61585 ci 61585 4474-24-2

ci 61585 ci 61585

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iupac名称 IUPAC Name :disodium;3-[[9,10-dioxo-4-(2,4,6-trimethyl-3-sulfonatoanilino)anthracen-1-yl]amino]-2,4,6-trimethylbenzenesulfonate

INCHI InChI :INCHI InChI=1/C32H30N2O8S2.2Na/c1-15-13-17(3)31(43(37,38)39)19(5)27(15)33-23-11-12-24(26-25(23)29(35)21-9-7-8-10-22(21)30(26)36)34-28-16(2)14-18(4)32(20(28)6)44(40,41)42;;/h7-14,33-34H,1-6H3,(H,37,38,39)(H,40,41,42);;/q;2*+1/p-2

印地 Std.InChI: INCHI InChI=1S/C32H30N2O8S2.2Na/c1-15-13-17(3)31(43(37,38)39)19(5)27(15)33-23-11-12-24(26-25(23)29(35)21-9-7-8-10-22(21)30(26)36)34-28-16(2)14-18(4)32(20(28)6)44(40,41)42;;/h7-14,33-34H,1-6H3,(H,37,38,39)(H,40,41,42);;/q;2*+1/p-2

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INCHI基 InChIKey :UHXQPQCJDDSMCB-NUQVWONBAO

标准奇奇 Std.InChIKey: UHXQPQCJDDSMCB-UHFFFAOYSA-L

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微笑 SMILES :[Na+].[Na+].[o- O-]S(= o =O)(= o =O)c1c(cc cc(c(c1C)Nc4c3C(= o =O)c2cc cccc ccc2C(= o =O)c3c(cc cc4)Nc5c(cc cc(c(c5C)S([o- O-])(= o =O)= o =O)C)C)C)C

MDL : mfcd00001192 MFCD00001192