Cytidine diphosphate choline

CAS Registry Number®

987-78-0
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CAS Name

Cytidine diphosphate choline

Molecular Formula

C14H26N4O11P2

Cite this Page

Cytidine diphosphate choline.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=987-78-0 (retrieved 2024-04-24) (CAS RN: 987-78-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C14H26N4O11P2/c1-18(2,3)6-7-26-30(22,23)29-31(24,25)27-8-9-11(19)12(20)13(28-9)17-5-4-10(15)16-14(17)21/h4-5,9,11-13,19-20H,6-8H2,1-3H3,(H3-,15,16,21,22,23,24,25)/t9-,11-,12-,13-/m1/s1

InChIKey

InChIKey=RZZPDXZPRHQOCG-OJAKKHQRSA-N

SMILES

O[C@H]1[C@@H](O[C@H](COP(OP(OCC[N+](C)(C)C)(=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[N+](C)(C)C)C(O)C2O

Other Names for this Substance

  • Cytidine 5′-(trihydrogen diphosphate), P′-[2-(trimethylammonio)ethyl] ester, inner salt
  • Cytidine 5′-(trihydrogen diphosphate), P′-[2-(trimethylammonio)ethyl] ester, hydroxide, inner salt
  • Choline, hydroxide, 5′-ester with cytidine 5′-(trihydrogen pyrophosphate), inner salt
  • Cytidine 5′-diphosphate choline
  • Citicoline

Deleted or Replaced CAS Registry Numbers

1477-47-0, 64143-42-6, 769081-33-6

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