Dataset

Geniposide (Not validated); LC-ESI-QTOF; MS2

This MassBank record with Accession MSBNK-RIKEN-PR309195 contains the MS2 mass spectrum of Geniposide (Not validated) with the InChIkey IBFYXTRXDNAPMM-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C17H24O10/c1-24-15(23)9-6-25-16(11-7(4-18)2-3-8(9)11)27-17-14(22)13(21)12(20)10(5-19)26-17/h2,6,8,10-14,16-22H,3-5H2,1H3
SMILES O=C(OC)C2=COC(OC1OC(CO)C(O)C(O)C1(O))C3C(=CCC23)CO
InChI Key IBFYXTRXDNAPMM-UHFFFAOYSA-N
Molecular Formula C17H24O10
Exact Mass 388.369 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-PR309195
Version
Author
Maintainer
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MetadataPublished 2019-03-28
Related Molecule
  • methyl 7-(hydroxymethyl)-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-4-carboxylate
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEBI:181845 chebi
    3515873 pubchem
    PD055988 probes_and_drugs
    HMDB0252679 hmdb
    Molport-008-322-986 molport
    The data in this table is sourced from UniChem at EBI.