ABE
Summary
| Name: | alpha-D-Abequopyranose |
| Synonyms: | alpha-D-Abequose 3,6-dideoxy-alpha-D-xylo-hexopyranose; 3,6-dideoxy-alpha-D-gulopyranose; 3,6-dideoxy-alpha-D-galactopyranose; 3-deoxy-alpha-D-fucopyranose; D-Abequose; Abequose |
| Formula: | C6 H12 O4 |
| Formal charge: | 0 |
| Formula weight: | 148.157 Da |
| Component type: | D-saccharide, alpha linking |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 3,6-dideoxy-alpha-D-xylo-hexopyranose |
| OpenEye OEToolkits | 1.5.0 | (2S,3R,5R,6R)-6-methyloxane-2,3,5-triol |
| GMML | 1.0 | DAbea |
| GMML | 1.0 | a-D-Abequopyranose |
| PDB-CARE | 1.0 | a-D-3-deoxy-Fucp |
| GMML | 1.0 | Abe |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | OC1C(OC(O)C(O)C1)C |
| SMILES_CANONICAL | CACTVS | 3.341 | C[C@H]1O[C@H](O)[C@H](O)C[C@H]1O |
| SMILES | CACTVS | 3.341 | C[CH]1O[CH](O)[CH](O)C[CH]1O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C[C@@H]1[C@@H](C[C@H]([C@H](O1)O)O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | CC1C(CC(C(O1)O)O)O |
| InChI | InChI | 1.03 | InChI=1S/C6H12O4/c1-3-4(7)2-5(8)6(9)10-3/h3-9H,2H2,1H3/t3-,4-,5-,6+/m1/s1 |
| InChIKey | InChI | 1.03 | KYPWIZMAJMNPMJ-KAZBKCHUSA-N |
