2-((4-bromo-2,3-dioxobutyl)thio)-adenosine 3/'5/'-cyclic monophosphate


CAS No. : 124357-33-1

2-((4-bromo-2,3-dioxobutyl)thio)-adenosine 3/
Product Details
Cat No:M019940
Synonyms:2-((4-bromo-2,3-dioxobutyl)thio)-adenosine 3/'5/'-cyclic monophosphate
Molecular Formula:C14H15BrN5O8PS
Molecular Weight:524.239
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Cat No:M019940
Cas No:124357-33-1
Product-Name:2-((4-bromo-2,3-dioxobutyl)thio)-adenosine 3/'5/'-cyclic monophosphate
IUPAC Name:[(2R,3S,4R,5R)-5-[6-amino-2-(4-bromo-4-oxobuta-1,2-dienyl)sulfanylpurin-9-yl]-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate
InChI:InChI=1S/C14H15BrN5O8PS/c15-7(21)2-1-3-30-14-18-11(16)8-12(19-14)20(5-17-8)13-10(23)9(22)6(28-13)4-27-29(24,25)26/h2-3,5-6,9-10,13,22-23H,4H2,(H2,16,18,19)(H2,24,25,26)/t1?,6-,9-,10-,13-/m1/s1
InChIKey:LCXDUKDMKLXADI-DWHWANRFSA-N
SMILES:C1=NC2=C(N1C3C(C(C(O3)COP(=O)(O)O)O)O)N=C(N=C2N)SC=C=CC(=O)Br
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