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CAS No.: | 95648-77-4 |
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Name: | 2'-Deoxyinosine-5'-triphosphate trisodium salt |
Molecular Structure: | |
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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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