| SpectraBase Spectrum ID |
JnR5wC6TmeD |
| Name |
D-Carnitine |
| Acquisition Mode |
SIMULTANEOUS |
| CAS Registry Number |
461-06-3 |
| ChEBI ID |
17126 |
| Comments |
100 mM D-carnitine - vendor: Sigma 544361; 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 |
C7H15NO3 |
| IUPAC Name |
3-hydroxy-4-trimethylammonio-butanoate |
| InChI |
InChI=1S/C7H15NO3/c1-8(2,3)5-6(9)4-7(10)11/h6,9H,4-5H2,1-3H3/p+1 |
| InChIKey |
PHIQHXFUZVPYII-UHFFFAOYSA-O |
| KEGG Compound ID |
C00487 |
| KEGG Pathways |
PATH: map00310 Lysine degradation
PATH: map02010 ABC transporters û General |
| PubChem Compound ID |
288 |
| SMILES |
C[N+](C)(C)CC(CC(=O)[O-])O |
| Source File Reference |
bmse000074 |
