AOG
Summary
| Name: | octyl 3-amino-3-deoxy-beta-D-galactopyranoside |
| Synonyms: | 4-AMINO-2-OCTYLOXY-6-HYDROXYMETHYL-TETRAHYDRO-PYRAN-3,5-DIOL octyl 3-amino-3-deoxy-beta-D-galactoside; octyl 3-amino-3-deoxy-D-galactoside; octyl 3-amino-3-deoxy-galactoside |
| Formula: | C14 H29 N O5 |
| Formal charge: | 0 |
| Formula weight: | 291.384 Da |
| Component type: | D-saccharide |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | octyl 3-amino-3-deoxy-beta-D-galactopyranoside |
| OpenEye OEToolkits | 1.5.0 | (2R,3R,4S,5R,6R)-4-amino-2-(hydroxymethyl)-6-octoxy-oxane-3,5-diol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O(CCCCCCCC)C1OC(C(O)C(N)C1O)CO |
| SMILES_CANONICAL | CACTVS | 3.341 | CCCCCCCCO[C@@H]1O[C@H](CO)[C@H](O)[C@H](N)[C@H]1O |
| SMILES | CACTVS | 3.341 | CCCCCCCCO[CH]1O[CH](CO)[CH](O)[CH](N)[CH]1O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CCCCCCCCO[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)N)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | CCCCCCCCOC1C(C(C(C(O1)CO)O)N)O |
| InChI | InChI | 1.03 | InChI=1S/C14H29NO5/c1-2-3-4-5-6-7-8-19-14-13(18)11(15)12(17)10(9-16)20-14/h10-14,16-18H,2-9,15H2,1H3/t10-,11+,12+,13-,14-/m1/s1 |
| InChIKey | InChI | 1.03 | HABUHWBZDNZBSI-MBJXGIAVSA-N |
