Dataset

Betamethasone 21-Acetate

This MassBank record with Accession MSBNK-Athens_Univ-AU203204 contains the MS2 mass spectrum of Betamethasone 21-Acetate with the InChIkey AKUJBENLRBOFTD-QZIXMDIESA-N.

Chemical Info

InChI	InChI=1S/C24H31FO6/c1-13-9-18-17-6-5-15-10-16(27)7-8-21(15,3)23(17,25)19(28)11-22(18,4)24(13,30)20(29)12-31-14(2)26/h7-8,10,13,17-19,28,30H,5-6,9,11-12H2,1-4H3/t13-,17-,18-,19-,21-,22-,23-,24-/m0/s1
SMILES	C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)COC(C)=O
InChI Key	AKUJBENLRBOFTD-QZIXMDIESA-N
Molecular Formula	C24H31FO6
Exact Mass	434.210 g/mol

Data and Resources

Betamethasone 21-AcetateHTML
Explore
- More information
- Go to resource

Metadata Information

Field	Value
DOI
License URL	https://creativecommons.org/licenses/by-sa/4.0
Source	https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Athens_Univ-AU203204
Version
Author
Maintainer
Language
MetadataCreated	2024-01-11T10:10:49.951224
MetadataModified	2025-02-08T19:06:30.099463
MetadataPublished	2015-12-03
Related Molecule

Field	Value
Measurement Technique	liquid chromatography-mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
443967	PubChem
PD071667	ProbesDrugs
15477356	PubChem: Thomson Pharma
987-24-6	ACToR
TI05AO53L7	FDA SRS
31229455	eMolecules
29534922	eMolecules
betamethasone acetate	DailyMed
ZINC000004212130	ZINC
CB1337284	ChemicalBook
SCHEMBL7592	SureChEMBL
31275	ChEBI
CHEMBL1200538	ChEMBL
BETAMETHASONE ACETATE	DailyMed
BETAMETHASONE ACETATE	rxnorm
J7.211G	Nikkaji
349	DrugCentral
BETAMETHASONE ACETATE	clinicaltrials
DTXSID8022668	EPA CompTox Dashboard
The data in this table is sourced from UniChem at EBI.