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95648-77-4

Basic Information
CAS No.: 95648-77-4
Name: 2'-Deoxyinosine-5'-triphosphate trisodium salt
Molecular Structure:
Molecular Structure of 95648-77-4 (2'-Deoxyinosine-5'-triphosphate trisodium salt)
Formula: C10H12N4Na3O13P3
Molecular Weight: 558.11
Synonyms: 2''-Deoxyinosine-5''-triphosphoric acid trisodium salt;
EINECS: 306-018-8
PSA: 290.77000
LogP: 0.42590
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    2'-Deoxyinosine-5'-triphosphate trisodium salt Basic information Product Name: 2'-Deoxyinosine-5'-triphosphate trisodium salt Synonyms: [hydroxy-[[(2R,3S,5R)-3-hydroxy-5-(6-oxo-3H-pur

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Specification

The 2''-Deoxyinosine-5''-triphosphoric acid trisodium salt, with the CAS registry number of 942490-07-5, is also known as 2''-Deoxyinosine-5''-triphosphoric acid trisodium salt. Its EINECS registry number is 306-018-8. This chemical's molecular formula is C10H12N4Na3O13P3 and molecular weight is 558.11. What's more, its systematic name is Trisodium 2'-deoxy-5'-O-[({[(hydroxyphosphinato)oxy]phosphinato}oxy)phosphinato]inosine.

Physical properties about the 2''-Deoxyinosine-5''-triphosphoric acid trisodium salt are: (1)#H bond acceptors: 17; (2)#H bond donors: 6; (3)#Freely Rotating Bonds: 9; (4)Polar Surface Area: 255.69 Å2.

You can still convert the following datas into molecular structure:
(1) SMILES: [Na+].[Na+].[Na+].[O-]P(=O)(O)OP([O-])(=O)OP([O-])(=O)OC[C@H]3O[C@@H](n1cnc2c1N\C=N/C2=O)C[C@@H]3O
(2) InChI: InChI=1/C10H15N4O13P3.3Na/c15-5-1-7(14-4-13-8-9(14)11-3-12-10(8)16)25-6(5)2-24-29(20,21)27-30(22,23)26-28(17,18)19;;;/h3-7,15H,1-2H2,(H,20,21)(H,22,23)(H,11,12,16)(H2,17,18,19);;;/q;3*+1/p-3/t5-,6+,7+;;;/m0.../s1
(3) InChIKey: FHYSVBOUQFJKCI-LJXXLRIRBH