Thymidine 5′-(trihydrogen diphosphate), P′-[(2R,6R)-5,6-dihydro-4-hydroxy-6-methyl-5-oxo-2H-pyran-2-yl] ester
CAS Registry Number®
321847-68-1
CAS Name
Thymidine 5′-(trihydrogen diphosphate), P′-[(2R,6R)-5,6-dihydro-4-hydroxy-6-methyl-5-oxo-2H-pyran-2-yl] esterMolecular Formula
C16H22N2O14P2Molecular Mass
528.30Cite this Page
Thymidine 5′-(trihydrogen diphosphate), P′-[(2R,6R)-5,6-dihydro-4-hydroxy-6-methyl-5-oxo-2H-pyran-2-yl] ester. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=321847-68-1 (retrieved ) (CAS RN: 321847-68-1). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C16H22N2O14P2/c1-7-5-18(16(23)17-15(7)22)12-3-9(19)11(30-12)6-28-33(24,25)32-34(26,27)31-13-4-10(20)14(21)8(2)29-13/h4-5,8-9,11-13,19-20H,3,6H2,1-2H3,(H,24,25)(H,26,27)(H,17,22,23)/t8-,9+,11-,12-,13-/m1/s1
InChIKey
InChIKey=QWDIAMULKXKCNE-NJIBTWPXSA-N
SMILES
O=C1N([C@@H]2O[C@H](COP(OP(O[C@@H]3C=C(O)C(=O)[C@@H](C)O3)(=O)O)(=O)O)[C@@H](O)C2)C=C(C)C(=O)N1
Canonical SMILES
O=C1NC(=O)N(C=C1C)C2OC(COP(=O)(O)OP(=O)(O)OC3OC(C(=O)C(O)=C3)C)C(O)C2
Other Names for this Substance
- Thymidine 5′-(trihydrogen diphosphate), P′-[(2R,6R)-5,6-dihydro-4-hydroxy-6-methyl-5-oxo-2H-pyran-2-yl] ester