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IUPAC Name: (2R,3R,4S,5R)-5-[[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxymethyl]-2-[3-(2-chloroacetyl)pyridin-1-ium-1-yl]-4-hydroxyoxolan-3-olate | CAS Registry Number: 39938-03-9
Synonyms: CAPAD, CID3081491, 3-Chloroacetylpyridine-adenine dinucleotide, Adenosine 5'-(trihydrogen diphosphate), 5'-5'-ester with 3-(chloroacetyl)-1-beta-D-ribofuranosylpyridinium hydroxide, inner salt, Adenosine 5'-(trihydrogen diphosphate), 5'-5'-ester with 3-(chloroacetyl)-1-beta-D-ribofuranosylpyridium hydroxide, inner salt

Molecular Formula:	C₂₂H₂₇ClN₆O₁₄P₂	Molecular Weight:	696.882102 [g/mol]
H-Bond Donor:	6	H-Bond Acceptor:	18

InChIKey: CLRURTWFYZNXCP-RBEMOOQDSA-N