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] ester

Molecular Formula

C16H22N2O14P2

Molecular Mass

528.30

Cite 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 2024-11-13) (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

CAS INSIGHTSTM
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