| SpectraBase Spectrum ID |
271sIFTmxAK |
| Name |
DL-Indole-3-lactic acid |
| Acquisition Mode |
SIMULTANEOUS |
| CAS Registry Number |
1821-52-9; 832-97-3 |
| ChEBI ID |
24813 |
| Comments |
Saturated dl-Indole-3-lactic acid - Sigma-Aldrich
Solvent D2O Buffer sodium phosphate Cytocide sodium azide Reference DSS; pH 7.4, temperature 298 K |
| Copyright |
Database Compilation Copyright © 2021-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Data Source |
Madison Metabolomics Consortium |
| Formula |
C11 H11 N O3 |
| IUPAC Name |
2-hydroxy-3-(1H-indol-3-yl)propanoic acid; 2-hydroxy-3-(1H-indol-3-yl)propionic acid |
| InChI |
InChI=1S/C11H11NO3/c13-10(11(14)15)5-7-6-12-9-4-2-1-3-8(7)9/h1-4,6,10,12-13H,5H2,(H,14,15) |
| InChIKey |
XGILAAMKEQUXLS-UHFFFAOYSA-N |
| KEGG Compound ID |
C02043 |
| KEGG Pathways |
PATH: ko00380 Tryptophan metabolism |
| PubChem Compound ID |
92904 |
| SMILES |
C1=CC=C2C(=C1)C(=CN2)CC(C(=O)O)O |
| Source File Reference |
bmse000409 |
