Dataset

17alpha-Hydroxyprogesterone; LC-ESI-QTOF; MS2; CE: 30 eV; R=35000; [M-H]-

This MassBank record with Accession MSBNK-Athens_Univ-AU239759 contains the MS2 mass spectrum of 17alpha-Hydroxyprogesterone with the InChIkey DBPWSSGDRRHUNT-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C21H30O3/c1-13(22)21(24)11-8-18-16-5-4-14-12-15(23)6-9-19(14,2)17(16)7-10-20(18,21)3/h12,16-18,24H,4-11H2,1-3H3
SMILES CC(=O)C1(O)CCC2C3CCC4=CC(=O)CCC4(C)C3CCC12C
InChI Key DBPWSSGDRRHUNT-UHFFFAOYSA-N
Molecular Formula C21H30O3
Exact Mass 330.219 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Athens_Univ-AU239759
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Author
Maintainer
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MetadataPublished 2019-03-29
Related Molecule
  • 17-acetyl-17-hydroxy-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    MCULE-3135517908 Mcule
    521928 PubChem
    29549718 eMolecules
    CHEMBL285584 ChEMBL
    HPRGDO CCDC
    PD118453 ProbesDrugs
    The data in this table is sourced from UniChem at EBI.