E5G
Summary
| Name: | 5-hydroxypentyl alpha-D-glucopyranoside |
| Synonyms: | 5-hydroxypentyl alpha-D-glucoside 5-hydroxypentyl D-glucoside; 5-hydroxypentyl glucoside |
| Formula: | C11 H22 O7 |
| Formal charge: | 0 |
| Formula weight: | 266.288 Da |
| Component type: | D-saccharide |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 5-hydroxypentyl alpha-D-glucopyranoside |
| OpenEye OEToolkits | 1.7.6 | (2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-(5-oxidanylpentoxy)oxane-3,4,5-triol |
| PDB-CARE | 1.0 | 5-hydroxypentyl-a-D-glucopyranoside |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O(CCCCCO)C1OC(C(O)C(O)C1O)CO |
| InChI | InChI | 1.03 | InChI=1S/C11H22O7/c12-4-2-1-3-5-17-11-10(16)9(15)8(14)7(6-13)18-11/h7-16H,1-6H2/t7-,8-,9+,10-,11+/m1/s1 |
| InChIKey | InChI | 1.03 | TUXAGTBBQDBLQC-NZFPMDFQSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | OCCCCCO[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O |
| SMILES | CACTVS | 3.370 | OCCCCCO[CH]1O[CH](CO)[CH](O)[CH](O)[CH]1O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | C(CCO)CCO[C@@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O |
| SMILES | OpenEye OEToolkits | 1.7.6 | C(CCO)CCOC1C(C(C(C(O1)CO)O)O)O |
