98J
Summary
| Name: | 5-HYDROXY-3-OXOPENTANOIC ACID |
| Formula: | C5 H8 O4 |
| Formal charge: | 0 |
| Formula weight: | 132.115 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 5-hydroxy-3-oxopentanoic acid |
| OpenEye OEToolkits | 1.9.2 | 5-oxidanyl-3-oxidanylidene-pentanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(O)CC(=O)CCO |
| InChI | InChI | 1.03 | InChI=1S/C5H8O4/c6-2-1-4(7)3-5(8)9/h6H,1-3H2,(H,8,9) |
| InChIKey | InChI | 1.03 | ANTBRXMMNBUYMS-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OCCC(=O)CC(O)=O |
| SMILES | CACTVS | 3.385 | OCCC(=O)CC(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | C(CO)C(=O)CC(=O)O |
| SMILES | OpenEye OEToolkits | 1.9.2 | C(CO)C(=O)CC(=O)O |
