DE2
Summary
| Name: | 1-deoxy-L-erythrulose |
| Formula: | C4 H8 O3 |
| Formal charge: | 0 |
| Formula weight: | 104.105 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (3S)-3,4-dihydroxybutan-2-one |
| OpenEye OEToolkits | 1.7.6 | (3S)-3,4-bis(oxidanyl)butan-2-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(C)C(O)CO |
| InChI | InChI | 1.03 | InChI=1S/C4H8O3/c1-3(6)4(7)2-5/h4-5,7H,2H2,1H3/t4-/m0/s1 |
| InChIKey | InChI | 1.03 | SEYLPRWNVFCVRQ-BYPYZUCNSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(=O)[C@@H](O)CO |
| SMILES | CACTVS | 3.385 | CC(=O)[CH](O)CO |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | CC(=O)[C@H](CO)O |
| SMILES | OpenEye OEToolkits | 1.7.6 | CC(=O)C(CO)O |
