UC6
Summary
| Name: | 1,5-anhydro-D-ribo-hex-3-ulose |
| Formula: | C6 H10 O5 |
| Formal charge: | 0 |
| Formula weight: | 162.141 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 1,5-anhydro-D-ribo-hex-3-ulose |
| OpenEye OEToolkits | 2.0.7 | (2~{S},3~{S},5~{R})-2-(hydroxymethyl)-3,5-bis(oxidanyl)oxan-4-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | OC1C(CO)OCC(O)C1=O |
| InChI | InChI | 1.06 | InChI=1S/C6H10O5/c7-1-4-6(10)5(9)3(8)2-11-4/h3-4,6-8,10H,1-2H2 |
| InChIKey | InChI | 1.06 | TWOSIGGTFLLPLQ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC[C@@H]1OC[C@@H](O)C(=O)[C@H]1O |
| SMILES | CACTVS | 3.385 | OC[CH]1OC[CH](O)C(=O)[CH]1O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | C1[C@H](C(=O)[C@H]([C@@H](O1)CO)O)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | C1C(C(=O)C(C(O1)CO)O)O |
