Dataset

(2S)-2-(3-aminopropanoylamino)-3-(3-methylimidazol-4-yl)propanoic acid, beta-Alanyl-3-methyl-L-histidine, L-Anserine nitrate salt, beta-Ala-3-Me-His

This MassBank record with Accession MSBNK-RIKEN_ReSpect-PT109860 contains the MS2 mass spectrum of (2S)-2-(3-aminopropanoylamino)-3-(3-methylimidazol-4-yl)propanoic acid, beta-Alanyl-3-methyl-L-histidine, L-Anserine nitrate salt, beta-Ala-3-Me-His with the InChIkey MYYIAHXIVFADCU-UHFFFAOYSA-N.

Chemical Info

InChI	InChI=1S/C10H16N4O3/c1-14-6-12-5-7(14)4-8(10(16)17)13-9(15)2-3-11/h5-6,8H,2-4,11H2,1H3,(H,13,15)(H,16,17)
SMILES	CN1C=NC=C1CC(C(=O)O)NC(=O)CCN
InChI Key	MYYIAHXIVFADCU-UHFFFAOYSA-N
Molecular Formula	C10H16N4O3
Exact Mass	240.263 g/mol

Data and Resources

(2S)-2-(3-aminopropanoylamino)-3-(3-methylimida...HTML
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Metadata Information

Field	Value
DOI
License URL	https://creativecommons.org/licenses/by-nc/4.0
Source	https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN_ReSpect-PT109860
Version
Author
Maintainer
Language
MetadataCreated	2024-01-11T21:06:56.593472
MetadataModified	2024-01-11T21:06:56.752507
MetadataPublished	2008-07-28

Field	Value
Measurement Technique	liquid chromatography-mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
PD099126	ProbesDrugs
SCHEMBL2771107	SureChEMBL
11444	PubChem
16885889	PubChem: Thomson Pharma
The data in this table is sourced from UniChem at EBI.