Dataset

N-Desmethylrosuvastatin

This MassBank record with Accession MSBNK-Eawag-EQ01154805 contains the MS2 mass spectrum of N-Desmethylrosuvastatin with the InChIkey DJUKMHIJCDJSIJ-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C21H26FN3O6S/c1-12(2)19-17(9-8-15(26)10-16(27)11-18(28)29)20(13-4-6-14(22)7-5-13)24-21(23-19)25-32(3,30)31/h4-9,12,15-16,26-27H,10-11H2,1-3H3,(H,28,29)(H,23,24,25)
SMILES CC(C)C1=NC(=NC(=C1C=CC(CC(CC(=O)O)O)O)C2=CC=C(C=C2)F)NS(=O)(=O)C
InChI Key DJUKMHIJCDJSIJ-UHFFFAOYSA-N
Molecular Formula C21H26FN3O6S
Exact Mass 467.153 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-EQ01154805
Version
Author
Maintainer
Language
MetadataCreated 2025-02-09T09:40:23.094963
MetadataModified 2025-02-09T09:40:23.258061
MetadataPublished 2024-05-08
Related Molecule
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
PD094751 ProbesDrugs
72618512 PubChem
The data in this table is sourced from UniChem at EBI.