MMS
Summary
| Name: | MIMOSINE |
| Synonyms: | 3-HYDROXY-4-OXO-1(4H)-PYRIDINEALANINE |
| Formula: | C8 H10 N2 O4 |
| Formal charge: | 0 |
| Formula weight: | 198.176 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 3-(3-hydroxy-4-oxopyridin-1(4H)-yl)-L-alanine |
| OpenEye OEToolkits | 1.5.0 | (2S)-2-amino-3-(3-hydroxy-4-oxo-pyridin-1-yl)propanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(O)C(N)CN1C=CC(=O)C(O)=C1 |
| SMILES_CANONICAL | CACTVS | 3.341 | N[C@@H](CN1C=CC(=O)C(=C1)O)C(O)=O |
| SMILES | CACTVS | 3.341 | N[CH](CN1C=CC(=O)C(=C1)O)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C1=CN(C=C(C1=O)O)C[C@@H](C(=O)O)N |
| SMILES | OpenEye OEToolkits | 1.5.0 | C1=CN(C=C(C1=O)O)CC(C(=O)O)N |
| InChI | InChI | 1.03 | InChI=1S/C8H10N2O4/c9-5(8(13)14)3-10-2-1-6(11)7(12)4-10/h1-2,4-5,12H,3,9H2,(H,13,14)/t5-/m0/s1 |
| InChIKey | InChI | 1.03 | WZNJWVWKTVETCG-YFKPBYRVSA-N |
