GCT
Summary
| Name: | 2,6-anhydro-3-deoxy-L-xylo-hexonic acid |
| Synonyms: | 4,5-DIHYDROXY-TETRAHYDRO-PYRAN-2-CARBOXYLIC ACID |
| Formula: | C6 H10 O5 |
| Formal charge: | 0 |
| Formula weight: | 162.141 Da |
| Component type: | D-saccharide |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 2,6-anhydro-3-deoxy-L-xylo-hexonic acid |
| OpenEye OEToolkits | 1.5.0 | (2S,4S,5S)-4,5-dihydroxyoxane-2-carboxylic acid |
| PDB-CARE | 1.0 | D-1,4-deoxy-GlcpA |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(O)C1OCC(O)C(O)C1 |
| SMILES_CANONICAL | CACTVS | 3.341 | O[C@H]1CO[C@@H](C[C@@H]1O)C(O)=O |
| SMILES | CACTVS | 3.341 | O[CH]1CO[CH](C[CH]1O)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C1[C@@H]([C@H](CO[C@@H]1C(=O)O)O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | C1C(C(COC1C(=O)O)O)O |
| InChI | InChI | 1.03 | InChI=1S/C6H10O5/c7-3-1-5(6(9)10)11-2-4(3)8/h3-5,7-8H,1-2H2,(H,9,10)/t3-,4-,5-/m0/s1 |
| InChIKey | InChI | 1.03 | YRPRHLNMFWDGSL-YUPRTTJUSA-N |
