Pseudouridine

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Systematic / IUPAC Name: (1S)-1,4-Anhydro-1-(2,4-dioxo-1,2,3,4-tetrahydro-5-pyrimidinyl)-D-ribitol

ID: Reference333

Other Names: 5-((2S,3R,4S,5R)-3,4-Dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)pyrimidine-2,4(1H,3H)-dione;
β-Pseudouridine;
5-Ribosyluracil;
(1S)-1,4-Anhydro-1-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)-D-ribitol;
β-δ-Pseudouridine ; more

Formula: C9H12N2O6

Class: Endogenous Metabolites

Spectral Data

Pseudouridine 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 173
Tandem Spectra MS1, MS2, MS3, MS4, MS5
Ionization Methods ESI
Analyzers FT
Last Modification 12/17/2014 11:05:28 AM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C9H12N2O6/c12-2-4-5(13)6(14)7(17-4)3-1-10-9(16)11-8(3)15/h1,4-7,12-14H,2H2,(H2,10,11,15,16)/t4-,5-,6-,7+/m1/s1
InChI Key PTJWIQPHWPFNBW-GBNDHIKLSA-N
Canonical SMILES C1=C(C(=O)NC(=O)N1)[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O
CAS 1445074
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Other Names 5-((2S,3R,4S,5R)-3,4-Dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)pyrimidine-2,4(1H,3H)-dione;
β-Pseudouridine;
5-Ribosyluracil;
(1S)-1,4-Anhydro-1-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)-D-ribitol;
β-δ-Pseudouridine;
5-β-δ-Ribofuranosyl-uracil;
2,4(1H,3H)-Pyrimidinedione, 5-β-D-ribofuranosyl-;
5-(β-D-Ribofuranosyl)pyrimidine-2,4(1H,3H)-dione

In Other Databases

ChemIDPlus 001445074
HMDb HMDB00767
ChEBI CHEBI:17802
PubChem 15047
KEGG C02067
Wikipedia Pseudouridine
ChemSpider 259675