112898-15-4,MFCD00058547
Catalog No.:AA0038Z6

112898-15-4 | 2′(3′)-O-(4-Benzoylbenzoyl)adenosine 5′-triphosphate triethylammonium salt

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
95%
1 week  
$104.00   $73.00
- +
5mg
95%
1 week  
$168.00   $118.00
- +
10mg
95%
1 week  
$235.00   $164.00
- +
50mg
95%
1 week  
$1,130.00   $791.00
- +
100mg
95%
1 week  
$1,797.00   $1,258.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA0038Z6
Chemical Name:
2′(3′)-O-(4-Benzoylbenzoyl)adenosine 5′-triphosphate triethylammonium salt
CAS Number:
112898-15-4
Molecular Formula:
C84H138N16O30P6
Molecular Weight:
2037.9263
MDL Number:
MFCD00058547
SMILES:
O=C(c1ccc(cc1)C(=O)c1ccccc1)O[C@@H]1[C@@H](COP(=O)(OP(=O)(OP(=O)(O)[O-])[O-])[O-])O[C@H]([C@@H]1O)n1cnc2c1ncnc2N.O=C(c1ccc(cc1)C(=O)c1ccccc1)O[C@@H]1[C@H](O)[C@H](O[C@H]1n1cnc2c1ncnc2N)COP(=O)(OP(=O)(OP(=O)(O)[O-])[O-])[O-].CC[NH+](CC)CC.CC[NH+](CC)CC.CC[NH+](CC)CC.CC[NH+](CC)CC.CC[NH+](CC)CC.CC[NH+](CC)CC
Properties
Computed Properties
 
Complexity:
1300  
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
4  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
54  
Hydrogen Bond Acceptor Count:
20  
Hydrogen Bond Donor Count:
6  
Isotope Atom Count:
0  
Rotatable Bond Count:
16  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  

Literature
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Tags:112898-15-4 Molecular Formula|112898-15-4 MDL|112898-15-4 SMILES|112898-15-4 2′(3′)-O-(4-Benzoylbenzoyl)adenosine 5′-triphosphate triethylammonium salt
Catalog No.: AA0038Z6
112898-15-4,MFCD00058547
112898-15-4 | 2′(3′)-O-(4-Benzoylbenzoyl)adenosine 5′-triphosphate triethylammonium salt
Pack Size: 1mg
Purity: 95%
1 week
$104.00 $73.00
Pack Size: 5mg
Purity: 95%
1 week
$168.00 $118.00
Pack Size: 10mg
Purity: 95%
1 week
$235.00 $164.00
Pack Size: 50mg
Purity: 95%
1 week
$1,130.00 $791.00
Pack Size: 100mg
Purity: 95%
1 week
$1,797.00 $1,258.00
Quantity
- +
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bulk Quotation Request
Technical Information
Catalog Number: AA0038Z6
Chemical Name: 2′(3′)-O-(4-Benzoylbenzoyl)adenosine 5′-triphosphate triethylammonium salt
CAS Number: 112898-15-4
Molecular Formula: C84H138N16O30P6
Molecular Weight: 2037.9263
MDL Number: MFCD00058547
SMILES: O=C(c1ccc(cc1)C(=O)c1ccccc1)O[C@@H]1[C@@H](COP(=O)(OP(=O)(OP(=O)(O)[O-])[O-])[O-])O[C@H]([C@@H]1O)n1cnc2c1ncnc2N.O=C(c1ccc(cc1)C(=O)c1ccccc1)O[C@@H]1[C@H](O)[C@H](O[C@H]1n1cnc2c1ncnc2N)COP(=O)(OP(=O)(OP(=O)(O)[O-])[O-])[O-].CC[NH+](CC)CC.CC[NH+](CC)CC.CC[NH+](CC)CC.CC[NH+](CC)CC.CC[NH+](CC)CC.CC[NH+](CC)CC
Properties
Complexity: 1300  
Covalently-Bonded Unit Count: 2  
Defined Atom Stereocenter Count: 4  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 54  
Hydrogen Bond Acceptor Count: 20  
Hydrogen Bond Donor Count: 6  
Isotope Atom Count: 0  
Rotatable Bond Count: 16  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
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