| SpectraBase Spectrum ID |
4zvY3Ee0fHE |
| Name |
Guanidineacetic acid |
| Acquisition Mode |
SIMULTANEOUS |
| CAS Registry Number |
352-97-6 |
| ChEBI ID |
16344 |
| Comments |
Saturated Guanidineacetic 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 |
C3 H7 N3 O2 |
| IUPAC Name |
2-(diaminomethylideneamino)acetic acid; 2-guanidinoacetic acid; 2-(diaminomethylideneamino)ethanoic acid |
| InChI |
InChI=1S/C3H7N3O2/c4-3(5)6-1-2(7)8/h1H2,(H,7,8)(H4,4,5,6) |
| InChIKey |
BPMFZUMJYQTVII-UHFFFAOYSA-N |
| KEGG Compound ID |
C00581 |
| KEGG Pathways |
PATH: ko00260 Glycine, serine and threonine metabolism
PATH: ko00330 Arginine and proline metabolism |
| PubChem Compound ID |
763 |
| SMILES |
C(C(=O)O)N=C(N)N |
| Source File Reference |
bmse000384 |
