Dataset

Valeryl-4-hydroxyvalsartan

This MassBank record with Accession MSBNK-Eawag-EQ01153153 contains the MS2 mass spectrum of Valeryl-4-hydroxyvalsartan with the InChIkey ICSQZMPILLPFKC-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C24H29N5O4/c1-15(2)22(24(32)33)29(21(31)13-8-16(3)30)14-17-9-11-18(12-10-17)19-6-4-5-7-20(19)23-25-27-28-26-23/h4-7,9-12,15-16,22,30H,8,13-14H2,1-3H3,(H,32,33)(H,25,26,27,28)
SMILES CC(C)C(C(=O)O)N(CC1=CC=C(C=C1)C2=CC=CC=C2C3=NNN=N3)C(=O)CCC(C)O
InChI Key ICSQZMPILLPFKC-UHFFFAOYSA-N
Molecular Formula C24H29N5O4
Exact Mass 451.222 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-EQ01153153
Version
Author
Maintainer
Language
MetadataCreated 2025-02-09T10:03:02.283240
MetadataModified 2025-02-09T10:03:02.466450
MetadataPublished 2024-05-08
Related Molecule
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
SCHEMBL3473671 SureChEMBL
17974863 PubChem
SCHEMBL24224465 SureChEMBL
PD120068 ProbesDrugs
The data in this table is sourced from UniChem at EBI.