APAC 514537

pro_cas
pro_cdbregno
CCD08007602
pro_formula
C9 H11 N2 O9 P . 2 Na
pro_molWeight
368.145

basic_info

Product_Name: APAC 514537
EnglishSynonyms: APAC 514537
pro_mdlNumber: MFCD00041795
pro_acceptors: 11
pro_donors: 3
pro_smile: c1cn(c(=O)[nH]c1=O)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)([O-])[O-])O)O.[Na+].[Na+]
InChi: InChI=1S/C9H13N2O9P.2Na/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(20-8)3-19-21(16,17)18;;/h1-2,4,6-8,13-14H,3H2,(H,10,12,15)(H2,16,17,18);;/q;2*+1/p-2/t4-,6-,7-,8-;;/m1../s1
InChiKey: InChIKey=KURVIXMFFSNONZ-WFIJOQBCSA-L

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