ci 60730 ci 60730 4430-18-6

ci 60730 ci 60730

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iupac名称 IUPAC Name :sodium;2-[(4-hydroxy-9,10-dioxoanthracen-1-yl)amino]-5-methylbenzenesulfonate

INCHI InChI :INCHI InChI=1/C21H15NO6S.Na/c1-11-6-7-14(17(10-11)29(26,27)28)22-15-8-9-16(23)19-18(15)20(24)12-4-2-3-5-13(12)21(19)25;/h2-10,22-23H,1h3 1H3,(H,26,27,28);/q;+1/p-1

印地 Std.InChI: INCHI InChI=1S/C21H15NO6S.Na/c1-11-6-7-14(17(10-11)29(26,27)28)22-15-8-9-16(23)19-18(15)20(24)12-4-2-3-5-13(12)21(19)25;/h2-10,22-23H,1h3 1H3,(H,26,27,28);/q;+1/p-1

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INCHI基 InChIKey :GTKIEPUIFBBXJQ-REWHXWOFAA

标准奇奇 Std.InChIKey: GTKIEPUIFBBXJQ-UHFFFAOYSA-M

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微笑 SMILES :[Na+].[o- O-]S(= o =O)(= o =O)c1cc(ccc1Nc4c3C(= o =O)c2ccccc2C(= o =O)c3c(O)cc4)C

MDL : mfcd00068446 MFCD00068446