DIRECT RED 4_ChemCD

DIRECT RED 4

basic_info
Product_Name：	DIRECT RED 4
EnglishSynonyms：	DIRECT RED 4
pro_mdlNumber：	MFCD00071856
pro_acceptors：	18
pro_donors：	4
pro_smile：	c1ccc(cc1)/N=N/c2c(cc3cc(ccc3c2O)NC(=O)Nc4ccc5c(c4)cc(c(c5O)/N=N/c6ccc7cc(ccc7c6)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]
InChi：	InChI=1S/C37H26N6O12S3.3Na/c44-35-29-12-9-25(15-22(29)18-31(57(50,51)52)33(35)42-40-24-4-2-1-3-5-24)38-37(46)39-26-10-13-30-23(16-26)19-32(58(53,54)55)34(36(30)45)43-41-27-8-6-21-17-28(56(47,48)49)11-7-20(21)14-27;;;/h1-19,44-45H,(H2,38,39,46)(H,47,48,49)(H,50,51,52)(H,53,54,55);;;/q;3*+1/p-3/b42-40+,43-41+;;;
InChiKey：	InChIKey=YEMIQCHVWHFHBC-VVVPJKEESA-K

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