Dataset

Guanosine (Not validated); LC-ESI-QTOF; MS2

This MassBank record with Accession MSBNK-RIKEN-PR309134 contains the MS2 mass spectrum of Guanosine (Not validated) with the InChIkey NYHBQMYGNKIUIF-UUOKFMHZSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C10H13N5O5/c11-10-13-7-4(8(19)14-10)12-2-15(7)9-6(18)5(17)3(1-16)20-9/h2-3,5-6,9,16-18H,1H2,(H3,11,13,14,19)/t3-,5-,6-,9-/m1/s1
SMILES C1=NC2=C(N1[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O)N=C(NC2=O)N
InChI Key NYHBQMYGNKIUIF-UUOKFMHZSA-N
Molecular Formula C10H13N5O5
Exact Mass 283.092 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-nc-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN-PR309134
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Maintainer
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MetadataPublished 2019-03-28
Related Molecule
  • 2-amino-9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purin-6-one
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    DB02857 drugbank
    CHEBI:16750 chebi
    GMP rcsb_pdb
    CHEMBL375655 chembl
    12212184 surechembl
    21217 surechembl
    27349775 surechembl
    2774083 surechembl
    135398635 pubchem
    12133JR80S fdasrs
    PD016219 probes_and_drugs
    GUANSH CCDC
    135518 brenda
    296 brenda
    HMDB0000133 hmdb
    1391230 bindingdb
    50738002 bindingdb
    Molport-001-792-491 molport
    Molport-002-507-342 molport
    Molport-042-652-600 molport
    The data in this table is sourced from UniChem at EBI.