Cytidine 5'-diphosphocholine

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Systematic / IUPAC Name: 4-Amino-1-{5-O-[hydroxy({hydroxy[2-(trimethylammonio)ethoxy]phosphoryl}oxy)phosphoryl]pentofuranosyl}-2(1H)-pyrimidinone

ID: Reference888

Other Names: Citicholine;
Citidoline;
Cyscholin;
Cytidoline;
Haocolin ; more

Formula: C14H27N4O11P2 +

Class: Endogenous Metabolites

Spectral Data

Cytidine 5'-diphosphocholine mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Elite
No. of Spectral Trees 1
No. of Spectra 291
Tandem Spectra MS1, MS2, MS3, MS4, MS5
Ionization Methods ESI
Analyzers FT
Last Modification 3/24/2015 2:48:11 PM
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Identificators

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
InChI Key RZZPDXZPRHQOCG-OJAKKHQRSA-N
Canonical SMILES C[N+](C)(C)CCOP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)N2C=CC(=NC2=O)N)O)O
CAS 987780
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Other Names Citicholine;
Citidoline;
Cyscholin;
Cytidoline;
Haocolin;
Nicholin;
Niticolin;
Recofnan;
Recognan;
Suncholin;
Colite;
Ensign;
Cereb;
Cdp-choline;
Nicolin;
Cytidine diphosphorylcholine;
Choline cytidine diphosphate;
Cytidine diphosphate cholin ester;
Citifar;
Hornbest;
Neucolis;
Sintoclar;
Somazine;
Reagin;
Rexort;
Audes

In Other Databases

ChEBI CHEBI:16436
PubChem 13804
KEGG D00057; C00307
ChEMBL CHEMBL1231700
ChemSpider 13207