Dataset

TRANS-4-HYDROXY-L-PROLINE

This MassBank record with Accession MSBNK-Antwerp_Univ-METOX_P102701_F638 contains the MS2 mass spectrum of TRANS-4-HYDROXY-L-PROLINE with the InChIkey PMMYEEVYMWASQN-DMTCNVIQSA-N.

Chemical Info

InChI	InChI=1S/C5H9NO3/c7-3-1-4(5(8)9)6-2-3/h3-4,6-7H,1-2H2,(H,8,9)/t3-,4+/m1/s1
SMILES	O[C@H]1CN[C@@H](C1)C(O)=O
InChI Key	PMMYEEVYMWASQN-DMTCNVIQSA-N
Molecular Formula	C5H9NO3
Exact Mass	131.058 g/mol

Data and Resources

TRANS-4-HYDROXY-L-PROLINEHTML
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Metadata Information

Field	Value
DOI
License URL	https://creativecommons.org/licenses/by/4.0
Source	https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Antwerp_Univ-METOX_P102701_F638
Version
Author
Maintainer
Language
MetadataCreated	2024-01-11T09:36:24.380762
MetadataModified	2025-02-08T18:46:41.124383
MetadataPublished	2021-12-10

Field	Value
Measurement Technique	liquid chromatography-mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
CHEMBL352418	ChEMBL
58375	ChEBI
HYP	PDBe
C01157	KEGG Ligand
228695	Brenda
HYDROXYPROLINE	rxnorm
HY-40135	MedChemExpress
50357233	BindingDB
4272	DrugCentral
J148.015D	Nikkaji
HOPROL	CCDC
MCULE-5389747201	Mcule
4704	Guide to Pharmacology
18095	ChEBI
221345	Brenda
DB08847	DrugBank
36576	Brenda
12713	Brenda
HMDB0000725	Human Metabolome Database
58375	Rhea
CB8357870	ChemicalBook
DTXSID10883225	EPA CompTox Dashboard
ZINC000000901791	ZINC
MTBLC58375	Metabolights
MTBLC18095	Metabolights
6646	Brenda
MCULE-6465399562	Mcule
SCHEMBL21185	SureChEMBL
16783819	PubChem: Thomson Pharma
15218989	PubChem: Thomson Pharma
6971053	PubChem
5810	PubChem
PD051320	ProbesDrugs
RMB44WO89X	FDA SRS
4hpro_LT	Recon
147028-80-6	ACToR
60020634	NMRShiftDB
521697	eMolecules
The data in this table is sourced from UniChem at EBI.