FLUORESCENT BRIGHTENER 28

pro_cas
pro_cdbregno
CCD00701240
pro_formula
C40 H44 N12 O10 S2 . H Na
pro_molWeight
940.992

basic_info

Product_Name: FLUORESCENT BRIGHTENER 28
EnglishSynonyms: FLUORESCENT BRIGHTENER 28
pro_mdlNumber: MFCD09028079
pro_acceptors: 22
pro_donors: 10
pro_smile: c1ccc(cc1)Nc2nc(nc(n2)N(CCO)CCO)Nc3ccc(c(c3)S(=O)(=O)O)/C=C\c4ccc(cc4S(=O)(=O)O)Nc5nc(nc(n5)N(CCO)CCO)Nc6ccccc6.[NaH]
InChi: InChI=1S/C40H44N12O10S2.Na.H/c53-21-17-51(18-22-54)39-47-35(41-29-7-3-1-4-8-29)45-37(49-39)43-31-15-13-27(33(25-31)63(57,58)59)11-12-28-14-16-32(26-34(28)64(60,61)62)44-38-46-36(42-30-9-5-2-6-10-30)48-40(50-38)52(19-23-55)20-24-56;;/h1-16,25-26,53-56H,17-24H2,(H,57,58,59)(H,60,61,62)(H2,41,43,45,47,49)(H2,42,44,46,48,50);;/b12-11-;;
InChiKey: InChIKey=CKCNJJZIDKBUGS-IPEZHVIRSA-N

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