Dataset

taxifolin; LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+

This MassBank record with Accession MSBNK-RIKEN_NPDepo-NGA03059 contains the MS2 mass spectrum of taxifolin with the InChIkey CXQWRCVTCMQVQX-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C15H12O7/c16-7-4-10(19)12-11(5-7)22-15(14(21)13(12)20)6-1-2-8(17)9(18)3-6/h1-5,14-19,21H
SMILES O=C1c2c(O)cc(O)cc2OC(c2ccc(O)c(O)c2)C1O
InChI Key CXQWRCVTCMQVQX-UHFFFAOYSA-N
Molecular Formula C15H12O7
Exact Mass 304.259 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-NGA03059
Version
Author
Maintainer
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MetadataPublished 2018-04-04
Related Molecule
  • 2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-2,3-dihydrochromen-4-one
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEBI:38747 chebi
    CHEMBL337309 chembl
    29358492 surechembl
    29390633 surechembl
    39570 surechembl
    471 pubchem
    PD014975 probes_and_drugs
    110839 brenda
    122986 brenda
    123517 brenda
    127320 brenda
    133005 brenda
    1502 brenda
    82122 brenda
    85302 brenda
    HMDB0242509 hmdb
    Molport-002-718-925 molport
    496932 bindingdb
    The data in this table is sourced from UniChem at EBI.