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- 6 of 8 defined stereocentres
- Non-standard isotope
[[(2R,4S,5R)-5-(6-aminopurin-9-yl)-3-hydroxy-4-phosphonooxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] [(2R,4S,5R)-5-(3-carbamoyl-2,4,4,5-tetradeuterio-1-pyridyl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl hydrogen phosphate
C1([2H])=CN(C([2H])=C(C1([2H])[2H])C(=N)O)[C@H]2[C@H](C([C@@H](COP(=O)(O)OP(=O)(O)OC[C@@H]3C([C@@H]([C@H](N4C=NC5=C(N)N=CN=C54)O3)OP(=O)(O)O)O)O2)O)O [2H]C1=CN(C(=C(C1([2H])[2H])C(=O)N)[2H])[C@H]2[C@H](C([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3C([C@@H]([C@@H](O3)n4cnc5c4ncnc5N)OP(=O)(O)O)O)O)O
InChI=1S/C21H30N7O17P3/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(44-46(33,34)35)14(30)11(43-21)6-41-48(38,39)45-47(36,37)40-5-10-13(29)15(31)20(42-10)27-3-1-2-9(4-27)18(23)32/h1,3-4,7-8,10-11,13-16,20-21,29-31H,2,5-6H2,(H2,23,32)(H,36,37)(H,38,39)(H2,22,24,25)(H2,33,34,35)/t10-,11-,13?,14?,15+,16+,20-,21-/m1/s1/i1D,2D2,4D
ACFIXJIJDZMPPO-IMEJRIOHSA-N
CSID:58784645, http://www.chemspider.com/Chemical-Structure.58784645.html (accessed 13:33, Apr 29, 2024)
Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00
Click to predict properties on the Chemicalize site
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