1JW
Summary
| Name: | (2S)-hexane-1,2,6-triol |
| Synonyms: | (-)-1,2,6-Hexanetriol 6999990 |
| Formula: | C6 H14 O3 |
| Formal charge: | 0 |
| Formula weight: | 134.174 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | (2~{S})-hexane-1,2,6-triol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C6H14O3/c7-4-2-1-3-6(9)5-8/h6-9H,1-5H2/t6-/m0/s1 |
| InChIKey | InChI | 1.03 | ZWVMLYRJXORSEP-LURJTMIESA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OCCCC[C@H](O)CO |
| SMILES | CACTVS | 3.385 | OCCCC[CH](O)CO |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | C(CCO)C[C@@H](CO)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | C(CCO)CC(CO)O |
