Dataset

Myricetin; LC-ESI-QTOF; MS2; CE:10 eV; [M-H]-

This MassBank record with Accession MSBNK-BS-BS003378 contains the MS2 mass spectrum of Myricetin with the InChIkey IKMDFBPHZNJCSN-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C15H10O8/c16-6-3-7(17)11-10(4-6)23-15(14(22)13(11)21)5-1-8(18)12(20)9(19)2-5/h1-4,16-20,22H
SMILES C1(=C(C(=C(C(=C1O[H])O[H])O[H])[H])C2=C(C(=O)C3=C(C(=C(C(=C3O2)[H])O[H])[H])O[H])O[H])[H]
InChI Key IKMDFBPHZNJCSN-UHFFFAOYSA-N
Molecular Formula C15H10O8
Exact Mass 318.038 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-BS-BS003378
Version
Author
Maintainer
Language
MetadataPublished 2017-12-01
Related Molecule
  • 3,5,7-trihydroxy-2-(3,4,5-trihydroxyphenyl)chromen-4-one
  • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    DB02375 drugbank
    CHEBI:18152 chebi
    LMPK12110001 lipidmaps
    MYC rcsb_pdb
    CHEMBL164 chembl
    19302 surechembl
    29357150 surechembl
    5281672 pubchem
    76XC01FTOJ fdasrs
    13074 gtopdb
    PD002690 probes_and_drugs
    NIKLAX CCDC
    124345 brenda
    136874 brenda
    156715 brenda
    186706 brenda
    211677 brenda
    243649 brenda
    27098 brenda
    484 brenda
    84023 brenda
    91846 brenda
    HMDB0002755 hmdb
    125575 bindingdb
    138015 bindingdb
    138917 bindingdb
    139293 bindingdb
    141388 bindingdb
    150275 bindingdb
    150570 bindingdb
    171923 bindingdb
    171960 bindingdb
    178760 bindingdb
    200577 bindingdb
    210126 bindingdb
    239472 bindingdb
    239711 bindingdb
    27903 bindingdb
    293060 bindingdb
    294230 bindingdb
    373990 bindingdb
    422036 bindingdb
    42505 bindingdb
    48712 bindingdb
    50001054 bindingdb
    50041522 bindingdb
    50049729 bindingdb
    50146966 bindingdb
    50153229 bindingdb
    50154693 bindingdb
    50154694 bindingdb
    50154696 bindingdb
    50263182 bindingdb
    50284417 bindingdb
    50286639 bindingdb
    50410888 bindingdb
    50416199 bindingdb
    50447122 bindingdb
    50504276 bindingdb
    50559359 bindingdb
    50563337 bindingdb
    50640496 bindingdb
    50640510 bindingdb
    50646282 bindingdb
    50646812 bindingdb
    50697858 bindingdb
    50756259 bindingdb
    50774883 bindingdb
    50789811 bindingdb
    50794971 bindingdb
    50794988 bindingdb
    50827191 bindingdb
    50837971 bindingdb
    50837994 bindingdb
    50838003 bindingdb
    50851292 bindingdb
    50863715 bindingdb
    50863721 bindingdb
    50872380 bindingdb
    50875321 bindingdb
    50903921 bindingdb
    50903929 bindingdb
    50925152 bindingdb
    50937444 bindingdb
    50937458 bindingdb
    50937472 bindingdb
    50965806 bindingdb
    50965856 bindingdb
    50987033 bindingdb
    50988321 bindingdb
    50988834 bindingdb
    50989548 bindingdb
    51017262 bindingdb
    51026641 bindingdb
    51054790 bindingdb
    51064301 bindingdb
    51090362 bindingdb
    51090376 bindingdb
    51110936 bindingdb
    51136760 bindingdb
    51136835 bindingdb
    51167184 bindingdb
    51168150 bindingdb
    51168180 bindingdb
    51168201 bindingdb
    51170806 bindingdb
    51173708 bindingdb
    51173724 bindingdb
    51184039 bindingdb
    51186101 bindingdb
    51186105 bindingdb
    51186123 bindingdb
    51189244 bindingdb
    51189268 bindingdb
    51191726 bindingdb
    51208102 bindingdb
    51221152 bindingdb
    51244047 bindingdb
    51257526 bindingdb
    51257527 bindingdb
    51257546 bindingdb
    51267052 bindingdb
    51267059 bindingdb
    51267896 bindingdb
    51267922 bindingdb
    51267938 bindingdb
    51272077 bindingdb
    51281420 bindingdb
    51289013 bindingdb
    51322713 bindingdb
    51322716 bindingdb
    51329148 bindingdb
    51368452 bindingdb
    51368462 bindingdb
    51386327 bindingdb
    51428639 bindingdb
    51428648 bindingdb
    51433638 bindingdb
    51435647 bindingdb
    51445447 bindingdb
    51483368 bindingdb
    51509819 bindingdb
    51525585 bindingdb
    51528659 bindingdb
    51535620 bindingdb
    51538838 bindingdb
    51543282 bindingdb
    51553198 bindingdb
    51571958 bindingdb
    902227 bindingdb
    902228 bindingdb
    Molport-001-740-532 molport
    The data in this table is sourced from UniChem at EBI.