5'-Adenylic acid, anhydride with acetic acid (1:1)

[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] acetate

Also Known As: Acetyl adenylate|Acetyladenylate|Acetyl amp|5'-Acetylphosphoadenosine|5 -Adenylic acid acetyl ester|5 -Adenylic acid acetic anhydride|5'-O-[acetoxy(hydroxy)phosphoryl]adenosine|5'-Adenylic acid, monoanhydride with acetic acid|5'-O-[(Acetyloxy)(hydroxy)phosphoryl]adenosine|5'-Adenylic acid, anhydride with acetic acid (1:1)|Acetic acid (adenosine 5 -phosphoric acid)anhydride|[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] acetate|(acetyloxy)({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy})phosphinic acid|[[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl] ethanoate|(((2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl)methoxy-hydroxyphosphoryl) acetate|(acetyloxy)((((2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl)methoxy))phosphinic acid|[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] acetate|6R9

Molecular Formula	C12H16N5O8P
Molecular Weight	389.07364 g/mol
LogP	-2.9
Topological Polar Surface Area	192.0 Ų
Hydrogen Bond Donors	4
Hydrogen Bond Acceptors	12
Rotatable Bonds	6
Exact Mass	389.07364
Monoisotopic Mass	389.07364
Heavy Atoms	26
Complexity	584.0

Chemical Identifiers

CAS Number	13015-87-7
SMILES	CC(=O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)O
InChIKey	UBPVOHPZRZIJHM-WOUKDFQISA-N