Dataset

Tyrosine

This MassBank record with Accession MSBNK-Washington_State_Univ-BML82295 contains the MS mass spectrum of Tyrosine with the InChIkey OUYCCCASQSFEME-UHFFFAOYSA-N.

Chemical Info

InChI	InChI=1S/C9H11NO3/c10-8(9(12)13)5-6-1-3-7(11)4-2-6/h1-4,8,11H,5,10H2,(H,12,13)
SMILES	C1=CC(=CC=C1CC(C(=O)O)N)O
InChI Key	OUYCCCASQSFEME-UHFFFAOYSA-N
Molecular Formula	C9H11NO3
Exact Mass	181.074 g/mol

Data and Resources

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Metadata Information

Field	Value
DOI
License URL	https://creativecommons.org/licenses/by-sa/4.0
Source	https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Washington_State_Univ-BML82295
Version
Author
Maintainer
Language
MetadataCreated	2024-01-11T22:24:41.703850
MetadataModified	2024-01-11T22:24:41.885122
MetadataPublished	2016-01-19

Field	Value
Measurement Technique	liquid chromatography-mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
MCULE-1694199256	Mcule
J598.196D	Nikkaji
HMDB0250803	Human Metabolome Database
10016962	NMRShiftDB
SCHEMBL1580	SureChEMBL
1153	PubChem
4300518	PubChem
15171329	PubChem: Thomson Pharma
PD055311	ProbesDrugs
60-18-4	ACToR
556-02-5	ACToR
556-03-6	ACToR
1991-85-1	ACToR
221971	Brenda
CB6686592	ChemicalBook
5965	Brenda
92998	Brenda
MTBLC18186	Metabolights
CB8112714	ChemicalBook
HY-Y0123	MedChemExpress
92702	BindingDB
DLTYRS	CCDC
A9BAT9B32M	FDA SRS
C01536	KEGG Ligand
CHEMBL108615	ChEMBL
18186	ChEBI
482111	eMolecules
29549112	eMolecules
The data in this table is sourced from UniChem at EBI.