Dataset

Foliosidine; LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+

This MassBank record with Accession MSBNK-RIKEN_NPDepo-NGA01225 contains the MS2 mass spectrum of Foliosidine with the InChIkey IUPYLWAXGAJZQC-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C16H21NO5/c1-16(2,20)13(18)9-22-11-7-5-6-10-12(21-4)8-14(19)17(3)15(10)11/h5-8,13,18,20H,9H2,1-4H3
SMILES COc1cc(=O)n(C)c2c(OCC(O)C(C)(C)O)cccc12
InChI Key IUPYLWAXGAJZQC-UHFFFAOYSA-N
Molecular Formula C16H21NO5
Exact Mass 307.349 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-RIKEN_NPDepo-NGA01225
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MetadataPublished 2018-04-04
Related Molecule
  • 8-(2,3-dihydroxy-3-methylbutoxy)-4-methoxy-1-methylquinolin-2-one
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEBI:91737 chebi
    CHEMBL1450334 chembl
    14029270 surechembl
    2837663 pubchem
    PD015185 probes_and_drugs
    Molport-002-140-205 molport
    The data in this table is sourced from UniChem at EBI.