Dataset

syringetin-3-O-glucoside, Syrg-3-Glc; LC-ESI-QQ; MS2

This MassBank record with Accession MSBNK-RIKEN_ReSpect-PS087108 contains the MS2 mass spectrum of syringetin-3-O-glucoside, Syrg-3-Glc with the InChIkey JMFWYRWPJVEZPV-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C23H24O13/c1-32-12-3-8(4-13(33-2)16(12)27)21-22(18(29)15-10(26)5-9(25)6-11(15)34-21)36-23-20(31)19(30)17(28)14(7-24)35-23/h3-6,14,17,19-20,23-28,30-31H,7H2,1-2H3
SMILES COC1=CC(=CC(=C1O)OC)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O
InChI Key JMFWYRWPJVEZPV-UHFFFAOYSA-N
Molecular Formula C23H24O13
Exact Mass 508.432 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-nc/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN_ReSpect-PS087108
Version
Author
Maintainer
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MetadataPublished 2009-02-09
Related Molecule
  • 5,7-dihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    70039686 NMRShiftDB
    14524434 PubChem
    The data in this table is sourced from UniChem at EBI.