| SpectraBase Spectrum ID |
6vnqGYRfXu7 |
| Name |
L-(-)-Arabitol |
| Acquisition Mode |
SIMULTANEOUS |
| CAS Registry Number |
7643-75-6 |
| ChEBI ID |
18403 |
| Comments |
100 mM L-(-) arabitol - vendor: Acros 225860050; 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 |
C5H12O5 |
| IUPAC Name |
(2S,4S)-pentane-1,2,3,4,5-pentol |
| InChI |
InChI=1S/C5H12O5/c6-1-3(8)5(10)4(9)2-7/h3-10H,1-2H2/t3-,4-/m0/s1 |
| InChIKey |
HEBKCHPVOIAQTA-IMJSIDKUSA-N |
| KEGG Compound ID |
C00532 |
| KEGG Pathways |
PATH: map00040 Pentose and glucuronate interconversions |
| PubChem Compound ID |
439255 |
| SMILES |
C(C(C(C(CO)O)O)O)O |
| Source File Reference |
bmse000068 |
