Dataset

Suberoylanilide hydroxamic acid; LC-ESI-QFT; MS2; CE: 75%; R=15000; [M+H]+

This MassBank record with Accession MSBNK-Eawag-EQ01070105 contains the MS2 mass spectrum of Suberoylanilide hydroxamic acid with the InChIkey WAEXFXRVDQXREF-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C14H20N2O3/c17-13(15-12-8-4-3-5-9-12)10-6-1-2-7-11-14(18)16-19/h3-5,8-9,19H,1-2,6-7,10-11H2,(H,15,17)(H,16,18)
SMILES C1=CC=C(C=C1)NC(=O)CCCCCCC(=O)NO
InChI Key WAEXFXRVDQXREF-UHFFFAOYSA-N
Molecular Formula C14H20N2O3
Exact Mass 264.147 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-Eawag-EQ01070105
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MetadataPublished 2024-06-14
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    Data-Source Molecule ID Data-Source
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    45716 ChEBI
    14823867 PubChem: Thomson Pharma
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    NSC-701852 clinicaltrials
    80021416 NMRShiftDB
    MCULE-4234367506 Mcule
    vorinostat DailyMed
    CB3506806 ChemicalBook
    217024 Brenda
    HMDB0015568 Human Metabolome Database
    151869 Brenda
    41261 Brenda
    7817 Brenda
    1547 Brenda
    PA164748224 PharmGKB
    DB02546 DrugBank
    CHEMBL98 ChEMBL
    SHH PDBe
    12015019 PubChem: Drugs of the Future
    206568 Brenda
    58IFB293JI FDA SRS
    VORINOSTAT DailyMed
    19149 BindingDB
    VORINOSTAT rxnorm
    MK-0683 clinicaltrials
    MK0683 clinicaltrials
    VORINOSTAT clinicaltrials
    ZOLINZA clinicaltrials
    HY-10221 MedChemExpress
    237067 Brenda
    DTXSID6041133 EPA CompTox Dashboard
    4124 DrugCentral
    ZINC000001543873 ZINC
    6852 Guide to Pharmacology
    J653.349C Nikkaji
    IQILAW CCDC
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    The data in this table is sourced from UniChem at EBI.