AG00G34N

74804-12-9 | Adenosine 5'-triphosphate dimagnesium salt

AG00G34N

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CAS Number	74804-12-9
Catalog Number	AG00G34N(AGN-PC-0U62DI)
Chemical Name	Adenosine 5'-triphosphate dimagnesium salt
IUPAC Name	magnesium;[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-oxidophosphoryl] hydrogen phosphate
InChI	InChI=1S/C10H16N5O13P3.Mg/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(26-10)1-25-30(21,22)28-31(23,24)27-29(18,19)20;/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H,23,24)(H2,11,12,13)(H2,18,19,20);/q;+2/p-2/t4-,6-,7-,10-;/m1./s1
InChI Key	CYYJCOXYBYJLIK-MCDZGGTQSA-L
MDL Number	MFCD00084767
Molecular Formula	C10H12Mg2N5O13P3
Molecular Weight	551.7593
SMILES	[Mg+2].[Mg+2].P([O-])(=O)(OP(=O)([O-])OP(=O)([O-])[O-])OC[C@@H]1[C@H]([C@H]([C@@H](O1)N1C=NC=2C(N)=NC=NC12)O)O
Synonyms	Adenosine Triphosphate, Adenosine Triphosphate, Calcium Salt, Adenosine Triphosphate, Chromium Ammonium Salt, Adenosine Triphosphate, Chromium Salt, Adenosine Triphosphate, Magnesium Chloride, Adenosine Triphosphate, Magnesium Salt, Adenosine Triphosphate, Manganese Salt, Adenylpyrophosphate, ATP, ATP MgCl2, ATP-MgCl2, Atriphos, CaATP, Chromium Adenosine Triphosphate, Cr(H2O)4 ATP, CrATP, Magnesium Adenosine Triphosphate, Manganese Adenosine Triphosphate, MgATP, MnATP, Striadyne, MgAtp, Magnesium ATP, Magnesiumsalz der atp [German], Adenosine 5'-triphosphate magnesium salt, 1476-84-2, MFCD00084767, ADENOSINE 5'-(TETRAHYDROGEN TRIPHOSPHATE), MAGNESIUM SALT, Adenosine 5'-(tetrahydrogen triphosphate) magnesium salt, 74804-12-9, Magnesiumsalz der atp, ATP magnesium salt, AC1L257T, CHEMBL2364734, SCHEMBL19947525, DTXSID30163753, AKOS016009253, LS-15179, magnesium [[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-oxidophosphoryl] hydrogen phosphate, C10H16N5O13P3.Mg, CID15126, C10-H16-N5-O13-P3.Mg, Adenosine-5'-triphosphate magnesium salt,

Complexity	789
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	4
Defined Bond Stereocenter Count	0
Exact Mass	528.965g/mol
Formal Charge	0
Heavy Atom Count	32
Hydrogen Bond Acceptor Count	17
Hydrogen Bond Donor Count	5
Isotope Atom Count	0
Molecular Weight	529.47g/mol
Monoisotopic Mass	528.965g/mol
Rotatable Bond Count	8
Topological Polar Surface Area	285A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	\N
Hazard statements	H371
Packing Group	\N
Precautionary statements	P260
UN Code	\N

Certificate of Analysis

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