ISL
Summary
| Name: | 6-O-alpha-D-glucopyranosyl-D-fructose |
| Synonyms: | 6-O-alpha-D-glucosyl-D-fructose 6-O-D-glucosyl-D-fructose; 6-O-glucosyl-D-fructose |
| Formula: | C12 H22 O11 |
| Formal charge: | 0 |
| Formula weight: | 342.296 Da |
| Component type: | D-saccharide |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 6-O-alpha-D-glucopyranosyl-D-fructose |
| OpenEye OEToolkits | 1.7.6 | (3S,4R,5R)-6-[(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-1,3,4,5-tetrakis(oxidanyl)hexan-2-on e |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(CO)C(O)C(O)C(O)COC1OC(C(O)C(O)C1O)CO |
| InChI | InChI | 1.03 | InChI=1S/C12H22O11/c13-1-4(15)7(17)8(18)5(16)3-22-12-11(21)10(20)9(19)6(2-14)23-12/h5-14,16-21H,1-3H2/t5-,6-,7-,8-,9-,10+,11-,12+/m1/s1 |
| InChIKey | InChI | 1.03 | RJPPRBMGVWEZRR-WTZPKTTFSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | OC[C@H]1O[C@H](OC[C@@H](O)[C@@H](O)[C@H](O)C(=O)CO)[C@H](O)[C@@H](O)[C@@H]1O |
| SMILES | CACTVS | 3.370 | OC[CH]1O[CH](OC[CH](O)[CH](O)[CH](O)C(=O)CO)[CH](O)[CH](O)[CH]1O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)OC[C@H]([C@H]([C@@H](C(=O)CO)O)O)O)O)O)O)O |
| SMILES | OpenEye OEToolkits | 1.7.6 | C(C1C(C(C(C(O1)OCC(C(C(C(=O)CO)O)O)O)O)O)O)O |
