CHEBI:229948 - N,N,N-Trimethyl-L-alanyl-L-proline betaine (TMAP)

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ChEBI Name N,N,N-Trimethyl-L-alanyl-L-proline betaine (TMAP)
ChEBI ID CHEBI:229948
Definition belongs to the class of organic compounds known as dipeptides. TMAP was previously an unknown potential plasma biomarker for glomerular filtration rate (GFR) but its structure has since been elucidated (PMID: 28706470 ). TMAP has also been identified as a potential plasma biomarker of reduced kidney function in early chronic kidney disease (CKD), end stage renal disease (ESRD), and hemodialytic clearance (PMID: 31048706 )
Stars This entity has been manually annotated by a third party.
Submitter Noemi Tejera
Supplier Information
Download Molfile XML SDF
Formula C11H20N2O3
Net Charge 0
Average Mass 228.292
Monoisotopic Mass 228.14739
InChI InChI=1S/C11H20N2O3/c1-8(13(2,3)4)10(14)12-7-5-6-9(12)11(15)16/h8-9H,5-7H2,1-4H3/t8-,9-/m0/s1
InChIKey KXONJPJIFNGMCN-IUCAKERBSA-N
SMILES C([C@H](C)[N+](C)(C)C)(=O)N1CCC[C@H]1C([O-])=O
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) See: MetaboLights Study
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
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ChEBI Ontology
Outgoing N,N,N-Trimethyl-L-alanyl-L-proline betaine (TMAP) (CHEBI:229948) is a dipeptide (CHEBI:46761)
IUPAC Name
(2S)-1-[(2S)-2-(trimethylazaniumyl)propanoyl]pyrrolidine-2-carboxylate
Manual Xref Database
HMDB0240365 HMDB accession
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Citation Waiting for Citations Type Source
28706470 PubMed citation SUBMITTER