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CAS No.: | 4578-31-8 |
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Name: | Disodium adenosine 5'-phosphate |
Molecular Structure: | |
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Formula: | C10H14N5Na2O7P |
Molecular Weight: | 391.188 |
Synonyms: | 5'-Adenylicacid, disodium salt (7CI,8CI,9CI);5'-AMP disodium salt;AMP disodium salt;Adenosine 5'-monophosphate disodium;Adenosine 5'-phosphate disodium salt;Adenosine-5'-monophosphate disodium salt;Adenylic acid disodium salt;Disodium5'-AMP;Disodium 9-(b-D-ribofuranosyl)adenine 5'-monophosphate;Disodium AMP;Disodium adenylate;disodium[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl phosphate; |
EINECS: | 224-961-2 |
Melting Point: | 232-235oC |
Boiling Point: | 798.5 °C at 760 mmHg |
Flash Point: | 436.7 °C |
Solubility: | soluble in water |
Appearance: | White powder |
Hazard Symbols: |
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Risk Codes: | 36/37/38 |
Safety: | 22-24/25-36-26 |
PSA: | 201.54000 |
LogP: | -0.40540 |
Conditions | Yield |
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Stage #1: adenosine In various solvent(s) at 20 - 100℃; for 0.333333h; Stage #2: With 2,6-dimethylpyridine; trichlorophosphate In various solvent(s) at 0℃; for 3h; | A 28% B 48% |
A
adenosine-5'-monophosphate disodium salt
Conditions | Yield |
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With phosphorating extract from S. cerevisiae at 28℃; for 8h; | A 8% B 30.5 mg C 11% |
Conditions | Yield |
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Multi-step reaction with 2 steps 1.1: various solvent(s) / 0.33 h / 20 - 100 °C 1.2: 48 percent / PSCl3; 2,6-lutidine / various solvent(s) / 3 h / 0 °C 2.1: 8 percent / phosphorating extract from S. cerevisiae / 8 h / 28 °C View Scheme |
Acridin-9-yl-[3-(1,13-dioxa-4,7,10,16,19,22-hexaaza-cyclotetracos-7-yl)-propyl]-amine; hydrochloride
adenosine diphosphate disodium salt
A
adenosine-5'-monophosphate disodium salt
Conditions | Yield |
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In water; water-d2 at 80℃; Rate constant; |
adenosine-5'-monophosphate disodium salt
Conditions | Yield |
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With water; zinc(II) cation pH=5.5; |
Conditions | Yield |
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With diadenosine 5',5'''-P1,P4-tetraphosphate (Ap4A) phosphorylase from Mycobacterium tuberculosis H37Rv at 37℃; for 0.5h; pH=7.6; Kinetics; aq. buffer; Enzymatic reaction; |
CoN(C3H6NH2)3(OH2)2(3+)
adenosine-5'-monophosphate disodium salt
Conditions | Yield |
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In water Kinetics; react. for about 6 h at 25°C;; elem. anal.; | 100% |
Conditions | Yield |
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With Dowex 50W×8 resin In water at 20℃; for 0.5h; | 99% |
With Dowex 50WX-8 200 mesh, H+ |
adenosine-5'-monophosphate disodium salt
α,β-D-ribofuranose-5-phophate disodium salt
Conditions | Yield |
---|---|
With Dowex 50 W-X8 (H+ form) In water for 0.141667h; Heating; | 94% |
adenosine-5'-monophosphate disodium salt
A
dirhodium tetracetate dihydrate
Conditions | Yield |
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In water slight excess of nucleotide, stirring for 5 h (dissoln.); pptn. on acetone addn.; elem. anal.; | A n/a B 80% |
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The 5'-Adenylic acid,sodium salt (1:2), with the CAS registry number 4578-31-8 and EINECS registry number 224-961-2, has the IUPAC name of disodium[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl phosphate. It is a kind of white powder, and belongs to product categories of Pharmaceutical Intermediates and Nucleic acids. And the molecular formula of the chemical is C10H14N5Na2O7P. It is always used in Biochemical research. What's more, it should be stored at -20°C.
The physical properties of 5'-Adenylic acid,sodium salt (1:2) are as followings: (1)ACD/LogP: -0.22; (2)# of Rule of 5 Violations: 2; (3)ACD/LogD (pH 5.5): -3.51; (4)ACD/LogD (pH 7.4): -4.47; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 12; (10)#H bond donors: 6; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 151.1 Å2; (13)Flash Point: 436.7 °C; (14)Enthalpy of Vaporization: 121.77 kJ/mol; (15)Boiling Point: 798.5 °C at 760 mmHg; (16)Vapour Pressure: 6.7E-27 mmHg at 25°C.
You should be cautious while dealing with this chemical. It irritates to eyes, respiratory system and skin. Therefore, you had better take the following instructions: Do not breathe dust and avoid contacting with skin and eyesWear suitable protective clothing, and in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1)SMILES: [Na+].[Na+].[O-]P([O-])(=O)OC[C@H]3O[C@@H](n2cnc1c(ncnc12)N)[C@H](O)[C@@H]3O
(2)InChI: InChI=1/C10H14N5O7P.2Na/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(22-10)1-21-23(18,19)20;;/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20);;/q;2*+1/p-2/t4-,6-,7-,10-;;/m1../s1
(3)InChIKey: QGXLVXZRPRRCRP-IMCBXCBXBL
The toxicity data is as follows:
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
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mouse | LD50 | intravenous | 830mg/kg (830mg/kg) | LUNGS, THORAX, OR RESPIRATION: RESPIRATORY DEPRESSION LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES | Takeda Kenkyusho Ho. Journal of the Takeda Research Laboratories. Vol. 33, Pg. 24, 1974. |