Dataset

Homoharringtonine; LC-ESI-QTOF; MS; POSITIVE

This MassBank record with Accession MSBNK-Washington_State_Univ-BML81420 contains the MS mass spectrum of Homoharringtonine with the InChIkey HYFHYPWGAURHIV-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C29H39NO9/c1-27(2,33)8-5-10-29(34,16-23(31)36-4)26(32)39-25-22(35-3)15-28-9-6-11-30(28)12-7-18-13-20-21(38-17-37-20)14-19(18)24(25)28/h13-15,24-25,33-34H,5-12,16-17H2,1-4H3
SMILES CC(C)(CCCC(CC(=O)OC)(C(=O)OC1C2C3=CC4=C(C=C3CCN5C2(CCC5)C=C1OC)OCO4)O)O
InChI Key HYFHYPWGAURHIV-UHFFFAOYSA-N
Molecular Formula C29H39NO9
Exact Mass 545.262 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Washington_State_Univ-BML81420
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Author
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MetadataPublished 2016-01-19
Related Molecule
  • 1-O-(4-methoxy-16,18-dioxa-10-azapentacyclo[11.7.0.02,6.06,10.015,19]icosa-1(20),4,13,15(19)-tetraen-3-yl) 4-O-methyl 2-hydroxy-2-(4-hydroxy-4-methylpentyl)butanedioate
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEMBL175858 chembl
    93487 surechembl
    3628 pubchem
    7454 gtopdb
    PD056579 probes_and_drugs
    HMDB0253207 hmdb
    Molport-044-567-569 molport
    The data in this table is sourced from UniChem at EBI.