Dataset

Triamcinolone acetonide; LC-ESI-Q; MS; POS; 30 V

This MassBank record with Accession MSBNK-Waters-WA002350 contains the MS mass spectrum of Triamcinolone acetonide with the InChIkey YNDXUCZADRHECN-JNQJZLCISA-N.

Chemical Information

molecular Image
InChI InChI=1S/C24H31FO6/c1-20(2)30-19-10-16-15-6-5-13-9-14(27)7-8-21(13,3)23(15,25)17(28)11-22(16,4)24(19,31-20)18(29)12-26/h7-9,15-17,19,26,28H,5-6,10-12H2,1-4H3/t15-,16-,17-,19+,21-,22-,23-,24+/m0/s1
SMILES C(C3O)C(C4(C(=O)CO)5)(C(CC4OC(C)(C)O5)(C(C32F)([H])CCC(C2(C)1)=CC(=O)C=C1)[H])C
InChI Key YNDXUCZADRHECN-JNQJZLCISA-N
Molecular Formula C24H31FO6
Exact Mass 434.210 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-nc/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Waters-WA002350
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Maintainer
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MetadataPublished 2016-01-19
Related Molecule
  • (1S,2S,4R,8S,9S,11S,12R,13S)-12-fluoro-11-hydroxy-8-(2-hydroxyacetyl)-6,6,9,13-tetramethyl-5,7-dioxapentacyclo[10.8.0.02,9.04,8.013,18]icosa-14,17-dien-16-one
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    C08183 KEGG Ligand
    CHEMBL1504 ChEMBL
    SAM002564237 NIH Clinical Collection
    ORALONE rxnorm
    TRIDERM rxnorm
    TRIAMCINOLONE ACETONIDE rxnorm
    ZILRETTA rxnorm
    VETALOG rxnorm
    NASACORT clinicaltrials
    TRIACET clinicaltrials
    TRIAM clinicaltrials
    TRIAMCINOLONE ACETONIDE clinicaltrials
    TRIDERM clinicaltrials
    KENACORT-A clinicaltrials
    KENALOG clinicaltrials
    ADCORTYL clinicaltrials
    AZMACORT clinicaltrials
    VOLON A clinicaltrials
    VETALOG clinicaltrials
    ZILRETTA clinicaltrials
    ORALONE clinicaltrials
    HY-B0636 MedChemExpress
    DTXSID6021371 EPA CompTox Dashboard
    2726 DrugCentral
    2867 Guide to Pharmacology
    J55.714E Nikkaji
    50248362 BindingDB
    HEQMUM CCDC
    TRIAMCINOLONE ACETONIDE DailyMed
    TRIESENCE rxnorm
    KENALOG rxnorm
    NASACORT rxnorm
    31590384 eMolecules
    14856757 PubChem: Thomson Pharma
    Triamcinolone-Acetonide Selleck
    SCHEMBL4689 SureChEMBL
    13586-95-3 ACToR
    LSM-5641 LINCS
    F446C597KA FDA SRS
    71418 ChEBI
    XIPERE clinicaltrials
    TRIESENCE clinicaltrials
    PD003160 ProbesDrugs
    14856756 PubChem: Thomson Pharma
    6436 PubChem
    594687 eMolecules
    36754828 eMolecules
    triamcinolone acetonide DailyMed
    CB4186553 ChemicalBook
    1TA PDBe
    ZINC000003875481 ZINC
    The data in this table is sourced from UniChem at EBI.