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Basic information
- CAS
102783-36-8- Standard SMILES
N.N.N.N.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3cnc4c(N)ncnc43)[C@H](O)[C@@H]2O)[C@@H](O)[C@H]1O- InChIKey
COBCSHRAXKIEQE-LKZCCGPLSA-N- Molecular formula
- C20H40N14O19P4
- Average molar mass
- 904.5 g/mol
- Monoisotopic mass
- 904.15446309
Names & identifiers
- Preferred name
- 5'-(Pentahydrogen tetraphosphate)adenosine 5'-5'-ester with adenosine tetraammonium salt
- IUPAC
- [[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl] hydrogen phosphate;azane
- English name
- A[5']P4[5']a ammonium salt
- Molecular formula
- C20H31N11O19P4
- Molecular weight
- 853.42
Names & synonyms
102783-36-85'-(Pentahydrogen tetraphosphate)adenosine 5'-5'-ester with adenosine tetraammonium salt[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl] hydrogen phosphate;azaneP1,P4-Di(adenosine-5') tetraphosphate ammonium saltDiadenosine 5',5'''-P(sup 1),P(sup 4)-tetraphosphate tetraammonium saltAdenosine, 5'-(pentahydrogen tetraphosphate), 5',5'-ester with adenosine, tetraammonium saltmoniumsalta(5')p4(5')aFormycin B-5'-triphosphatA[5']P4[5']a ammonium saltFludarabine Phosphate Impurity 33P1,P4-Di(adenosine-5′) tetraphosphate
Show more names
DIADENOSINE TETRAPHOSPHATE AMMONIUM SALTP1,P4-DI(ADENOSINE-5')TETRAPHOSPHATEAMMO NIUMP1,P4-DI(ADENOSINE-5') TETRAPHOSPHATE AMMONIUM SA...
Properties
Computed structural propertiesFilling in
- Topological polar surface area
- 438 Ų
- Hydrogen bond donors
- 14
- Hydrogen bond acceptors
- 31
- Rotatable bonds
- 14
- Heavy atoms
- 57
- Formal charge
- 0
- Complexity
- 1,410
Physicochemical properties
- storage temp.
- -20 °C · -20°C
- solubility
- 2 O: · H2O: 50 mg/mL
- form
- powder
- color
- white
- Water Solubility
- 2 O: · H2O: 50mg/mL
- InChIKey
- JTLRVYSRZSPJKJ-AHKIGRPSSA-N
- SMILES
- N.Nc1ncnc2n(cnc12)[C@@H]3O[C@H](COP(O)(=O)OP(O)(=O)OP(O)(=O)OP(O)(=O)OC[C@H]4O[C@H]([C@H](O)[C@@H]4O)n5cnc6c(N)ncnc56)[C@@H](O)[C@H]3O
- UNSPSC Code
- 41106305 · 41106305
- NACRES
- 77 · NA.77
- PPE
- 95 · Eyeshields, Gloves, type N95 (US)
- Safety Statements
- 22 · 22-24/25
- WGK Germany
- 3 · 3
- RTECS
- 7411600 · AU7411600
- Storage Class
- 11 · 11 - Combustible Solids
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- PPE
- Eyeshields, Gloves, type N95 (US)
- wgk
- 3
- rtecs
- AU7411600
- safety_code
- 22-24/25
- Storage Class
- 11 - Combustible Solids
Chemistry & industry
Applications
UsesP1,P4-Di(adenosine-5’) Tetraphosphate Ammonium Salt is a derivative of Diadenosine polyphosphate, which is stored in secretory granules of thrombocytes.
UsesP1,P4-Di(adenosine-5′) tetraphosphate ammonium salt has been used as a substrate for nudix hydrolyse. It has also been used as a ATP analog and nudix substrate for cleavage factor II Im25 subunit.
Suppliers13 total
Aladdin Scientific[email protected]
怀化市冰峰化工有限公司0745-2866851 17711757908 · [email protected]
上海梅凯科技有限公司021-68689288 15300790979 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
BOC Sciences16314854226 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
上海颖心实验室设备有限公司021-021-59178156 15300768757 · [email protected]
西安莱茵生物科技有限公司86-(0)29-85992781 17792393971 · [email protected]
Novachemistry44-20819178-90 02081917890 · [email protected]
BOC Sciences+1-631-485-4226 · [email protected]
济南思考化学有限公司0531-0000 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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