Dataset

Testosterone; LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M+H]+

This MassBank record with Accession MSBNK-Athens_Univ-AU280202 contains the MS2 mass spectrum of Testosterone with the InChIkey MUMGGOZAMZWBJJ-DYKIIFRCSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C19H28O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h11,14-17,21H,3-10H2,1-2H3/t14-,15-,16-,17-,18-,19-/m0/s1
SMILES C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@@H]2O
InChI Key MUMGGOZAMZWBJJ-DYKIIFRCSA-N
Molecular Formula C19H28O2
Exact Mass 288.209 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-AU280202
Version
Author
Maintainer
Language
MetadataPublished 2019-05-31
Related Molecule
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    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
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    ZINC000118912393 ZINC
    MTBLC17347 Metabolights
    104350 Brenda
    6013 PubChem
    MCULE-1294118086 Mcule
    SCHEMBL8452 SureChEMBL
    PD002847 ProbesDrugs
    14849069 PubChem: Thomson Pharma
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    14873306 PubChem: Thomson Pharma
    PA451627 PharmGKB
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    3XMK78S47O FDA SRS
    60021092 NMRShiftDB
    511977 eMolecules
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    8885 BindingDB
    TESTOPEL rxnorm
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    STRIANT rxnorm
    FORTESTA rxnorm
    VOGELXO rxnorm
    AXIRON rxnorm
    ANDROGEL rxnorm
    NATESTO rxnorm
    ANDRODERM rxnorm
    INTRINSA clinicaltrials
    TESTIM clinicaltrials
    VOGELXO clinicaltrials
    ANDRODERM clinicaltrials
    ANDROGEL clinicaltrials
    NATESTO clinicaltrials
    TESTOSTERONE clinicaltrials
    LIVENSA clinicaltrials
    DTXSID8022371 EPA CompTox Dashboard
    LMST02020002 LipidMaps
    2607 DrugCentral
    2858 Guide to Pharmacology
    J4.590J Nikkaji
    TESTON CCDC
    TESTIM rxnorm
    284 Brenda
    SLM:000001059 SwissLipids
    12012605 PubChem: Drugs of the Future
    DB00624 DrugBank
    CHEMBL386630 ChEMBL
    C00535 KEGG Ligand
    TES PDBe
    17347 ChEBI
    SAM001246921 NIH Clinical Collection
    The data in this table is sourced from UniChem at EBI.