Dataset

URIDINEMONOPHOSPHATE; LC-ESI-QTOF; MS2; CE: 40eV; R=5000; [M+H]+

This MassBank record with Accession MSBNK-Antwerp_Univ-METOX_P103601_FB57 contains the MS2 mass spectrum of URIDINEMONOPHOSPHATE with the InChIkey DJJCXFVJDGTHFX-XVFCMESISA-N.

Chemical Information

molecular Image
InChI InChI=1S/C9H13N2O9P/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(20-8)3-19-21(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,10,12,15)(H2,16,17,18)/t4-,6-,7-,8-/m1/s1
SMILES O[C@H]1[C@@H](O)[C@@H](O[C@@H]1COP(O)(O)=O)N1C=CC(=O)NC1=O
InChI Key DJJCXFVJDGTHFX-XVFCMESISA-N
Molecular Formula C9H13N2O9P
Exact Mass 324.036 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Antwerp_Univ-METOX_P103601_FB57
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MetadataPublished 2021-12-23
Related Molecule
  • [(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    DB03685 drugbank
    CHEBI:16695 chebi
    U rcsb_pdb
    U5P rcsb_pdb
    CHEMBL214393 chembl
    157644 surechembl
    6030 pubchem
    E2OU15WN0N fdasrs
    PD051725 probes_and_drugs
    QAXGUV CCDC
    101700 brenda
    113279 brenda
    124492 brenda
    133 brenda
    140759 brenda
    178500 brenda
    182285 brenda
    24533 brenda
    46411 brenda
    7434 brenda
    915 brenda
    95340 brenda
    HMDB0000288 hmdb
    Molport-006-110-136 molport
    50398699 bindingdb
    The data in this table is sourced from UniChem at EBI.