Cytidine 5′-(trihydrogen diphosphate), P′-(2,3-dihydroxypropyl) ester

CAS Registry Number®

6665-99-2
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CAS Name

Cytidine 5′-(trihydrogen diphosphate), P′-(2,3-dihydroxypropyl) ester

Molecular Formula

C12H21N3O13P2

Molecular Mass

477.26

Cite this Page

Cytidine 5′-(trihydrogen diphosphate), P′-(2,3-dihydroxypropyl) ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=6665-99-2 (retrieved 2024-09-20) (CAS RN: 6665-99-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C12H21N3O13P2/c13-8-1-2-15(12(20)14-8)11-10(19)9(18)7(27-11)5-26-30(23,24)28-29(21,22)25-4-6(17)3-16/h1-2,6-7,9-11,16-19H,3-5H2,(H,21,22)(H,23,24)(H2,13,14,20)/t6?,7-,9-,10-,11-/m1/s1

InChIKey

InChIKey=HHPOUCCVONEPRK-JANFQQFMSA-N

SMILES

O[C@H]1[C@@H](O[C@H](COP(OP(OCC(CO)O)(=O)O)(=O)O)[C@H]1O)N2C(=O)N=C(N)C=C2

Canonical SMILES

O=C1N=C(N)C=CN1C2OC(COP(=O)(O)OP(=O)(O)OCC(O)CO)C(O)C2O

Other Names for this Substance

  • Cytidine 5′-(trihydrogen diphosphate), P′-(2,3-dihydroxypropyl) ester
  • Cytidine 5′-(trihydrogen pyrophosphate), mono(L-glycero-2,3-dihydroxypropyl) ester
  • Cytidine 5′-pyrophosphate, 2,3-dihydroxypropyl ester
  • Cytidine diphosphate glycerol
  • Cytidine diphosphoglycerol

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Deleted or Replaced CAS Registry Numbers

4331-05-9, 10051-57-7, 148975-30-8