3-ACETYLPYRIDINE TPN, SODIUM_Chemical Cloud Database

3-ACETYLPYRIDINE TPN, SODIUM

Basic Information
Product Name：	3-ACETYLPYRIDINE TPN, SODIUM
English Synonyms：	3-ACETYLPYRIDINE TPN, SODIUM
MDL Number.：	MFCD00272704
H bond acceptor：	23
H bond donor：	4
Smile：	CC(=O)c1ccc[n+](c1)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)([O-])OP(=O)([O-])OC[C@@H]3[C@H]([C@H]([C@@H](O3)n4cnc5c4ncnc5N)OP(=O)([O-])[O-])O)O)O.[Na+].[Na+].[Na+]
InChi：	InChI=1S/C22H29N6O17P3.3Na/c1-10(29)11-3-2-4-27(5-11)21-17(32)15(30)12(42-21)6-40-47(36,37)45-48(38,39)41-7-13-16(31)18(44-46(33,34)35)22(43-13)28-9-26-14-19(23)24-8-25-20(14)28;;;/h2-5,8-9,12-13,15-18,21-22,30-32H,6-7H2,1H3,(H5-,23,24,25,33,34,35,36,37,38,39);;;/q;3*+1/p-3/t12-,13-,15-,16-,17-,18-,21-,22-;;;/m1.../s1
InChiKey：	InChIKey=ISOBQQWSUIEVCS-QCGLPDTESA-K

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