Dataset

Flavanone base + 4O, 2Prenyl; LC-ESI-QTOF; MS2

This MassBank record with Accession MSBNK-RIKEN-PR309043 contains the MS2 mass spectrum of Flavanone base + 4O, 2Prenyl with the InChIkey HCBKENVWCDLQOA-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C25H28O6/c1-13(2)5-7-15-9-16(10-21(29)24(15)30)22-12-20(28)23-19(27)11-18(26)17(25(23)31-22)8-6-14(3)4/h5-6,9-11,22,26-27,29-30H,7-8,12H2,1-4H3
SMILES O=C2C3=C(O)C=C(O)C(=C3(OC(C1=CC(O)=C(O)C(=C1)CC=C(C)C)C2))CC=C(C)C
InChI Key HCBKENVWCDLQOA-UHFFFAOYSA-N
Molecular Formula C25H28O6
Exact Mass 424.493 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-PR309043
Version
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Maintainer
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MetadataPublished 2019-03-28
Related Molecule
  • 2-[3,4-dihydroxy-5-(3-methylbut-2-enyl)phenyl]-5,7-dihydroxy-8-(3-methylbut-2-enyl)-2,3-dihydrochromen-4-one
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    124596-89-0 ACToR
    70072292 NMRShiftDB
    HMDB0038868 Human Metabolome Database
    SCHEMBL1170822 SureChEMBL
    LMPK12140402 LipidMaps
    175410 ChEBI
    J592.858C Nikkaji
    480770 PubChem
    The data in this table is sourced from UniChem at EBI.