OWENS BLUE_ChemCD

OWENS BLUE

basic_info
Product_Name：	OWENS BLUE
EnglishSynonyms：	TRISODIUM 4-AMINO-6-[2-(4-(4-[2-(8-AMINO-1-HYDROXY-3-SULFONATONAPHTHALEN-2-YL)DIAZEN-1-YL]PHENYL)PHENYL)DIAZEN-1-YL]-5-HYDROXY-3-[2-(4-NITROPHENYL)DIAZEN-1-YL]NAPHTHALENE-2,7-DISULFONATE ; OWENS BLUE
pro_mdlNumber：	MFCD03939117
pro_acceptors：	22
pro_donors：	4
pro_smile：	c1cc2cc(c(c(c2c(c1)N)O)/N=N/c3ccc(cc3)c4ccc(cc4)/N=N/c5c(cc6cc(c(c(c6c5O)N)/N=N/c7ccc(cc7)[N+](=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]
InChi：	InChI=1S/C38H27N9O13S3.3Na/c39-27-3-1-2-21-16-29(62(55,56)57)35(37(48)31(21)27)45-42-23-8-4-19(5-9-23)20-6-10-24(11-7-20)43-46-36-30(63(58,59)60)18-22-17-28(61(52,53)54)34(33(40)32(22)38(36)49)44-41-25-12-14-26(15-13-25)47(50)51;;;/h1-18,48-49H,39-40H2,(H,52,53,54)(H,55,56,57)(H,58,59,60);;;/q;3*+1/p-3/b44-41+,45-42+,46-43+;;;
InChiKey：	InChIKey=JJPFJLVWGZUQSV-OJEQMUCHSA-K

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