5'-XANTHYLIC ACID, 2-S-(2-FURANYLMETHYL)-2-THIO-, DISODIUM SALT

pro_cas
31192-08-2
pro_cdbregno
CCD03290457
pro_formula
C15 H15 N4 O9 P S . 2 Na
pro_molWeight
504.323

basic_info

Product_Name: 5'-XANTHYLIC ACID, 2-S-(2-FURANYLMETHYL)-2-THIO-, DISODIUM SALT
CAS: 31192-08-2
EnglishSynonyms: 5'-XANTHYLIC ACID, 2-S-(2-FURANYLMETHYL)-2-THIO-, DISODIUM SALT
pro_mdlNumber: MFCD17019455
pro_acceptors: 13
pro_donors: 3
pro_smile: c1cc(oc1)CSc2[nH]c3c(c(=O)n2)ncn3[C@H]4[C@@H]([C@@H]([C@H](O4)COP(=O)([O-])[O-])O)O.[Na+].[Na+]
InChi: InChI=1S/C15H17N4O9PS.2Na/c20-10-8(4-27-29(23,24)25)28-14(11(10)21)19-6-16-9-12(19)17-15(18-13(9)22)30-5-7-2-1-3-26-7;;/h1-3,6,8,10-11,14,20-21H,4-5H2,(H,17,18,22)(H2,23,24,25);;/q;2*+1/p-2/t8-,10-,11-,14-;;/m1../s1
InChiKey: InChIKey=AKLUPQCBRDHYRL-JQCMHQHXSA-L

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