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l-Proline
SpectraBase Compound ID AjuUv3zR1sd
InChI InChI=1S/C5H9NO2/c7-5(8)4-2-1-3-6-4/h4,6H,1-3H2,(H,7,8)/t4-/m0/s1
InChIKey ONIBWKKTOPOVIA-BYPYZUCNSA-N
Mol Weight 115.13 g/mol
Molecular Formula C5H9NO2
Exact Mass 115.063329 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Cj5KzFZU926
Name L-Proline
Acquisition Mode SIMULTANEOUS
CAS Registry Number 147-85-3 7005-20-1
ChEBI ID 17203
Comments 100 mM L-Proline - vendor: Sigma p0380; Solvent: D2O; Buffers, etc: 50 mM Sodium Phosphate, 500 uM NaAzide; Temperature=298 K, pH=7.4; NMR Reference: 500 uM DSS; Bruker DMX 400MHz (Data collected by Madison Metabolomics Consortium)
Copyright Database Compilation Copyright © 2021-2024 John Wiley & Sons, Inc. All Rights Reserved.
Data Source Madison Metabolomics Consortium
Formula C5H9NO2
IUPAC Name (2R)-pyrrolidine-2-carboxylic acid
InChI InChI=1S/C5H9NO2/c7-5(8)4-2-1-3-6-4/h4,6H,1-3H2,(H,7,8)/t4-/m0/s1
InChIKey ONIBWKKTOPOVIA-BYPYZUCNSA-N
KEGG Compound ID C00148
KEGG Pathways PATH: map00330 Arginine and proline metabolism PATH: map00401 Novobiocin biosynthesis PATH: map00970 Aminoacyl-tRNA biosynthesis PATH: map02010 ABC transporters - General
PubChem Compound ID 8988
SMILES C1CC(NC1)C(=O)O
Source File Reference bmse000047