DLG
概要
| 表記: | hexyl 3-deoxy-beta-D-galactopyranoside |
| 別名: | HEXYL 3-DEOXY-BETA-D-GALACTOPYRANOSE 2-HEXYLOXY-6-HYDROXYMETHYL-TETRAHYDRO-PYRAN-3,5-DIOL; hexyl 3-deoxy-beta-D-galactoside; hexyl 3-deoxy-D-galactoside; hexyl 3-deoxy-galactoside |
| 組成式: | C12 H24 O5 |
| 電荷: | 0 |
| 化学式量: | 248.316 Da |
| 分子種別: | D-saccharide |
化合物名
| プログラム | バージョン | 表記 |
| ACDLabs | 10.04 | hexyl 3-deoxy-beta-D-xylo-hexopyranoside |
| OpenEye OEToolkits | 1.5.0 | (2R,3R,5R,6R)-2-hexoxy-6-(hydroxymethyl)oxane-3,5-diol |
化合物記述子（線形表記）
| 種別 | プログラム | バージョン | 表記 |
| SMILES | ACDLabs | 10.04 | O(CCCCCC)C1OC(C(O)CC1O)CO |
| SMILES_CANONICAL | CACTVS | 3.341 | CCCCCCO[C@@H]1O[C@H](CO)[C@H](O)C[C@H]1O |
| SMILES | CACTVS | 3.341 | CCCCCCO[CH]1O[CH](CO)[CH](O)C[CH]1O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CCCCCCO[C@H]1[C@@H](C[C@H]([C@H](O1)CO)O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | CCCCCCOC1C(CC(C(O1)CO)O)O |
| InChI | InChI | 1.03 | InChI=1S/C12H24O5/c1-2-3-4-5-6-16-12-10(15)7-9(14)11(8-13)17-12/h9-15H,2-8H2,1H3/t9-,10-,11-,12-/m1/s1 |
| InChIKey | InChI | 1.03 | TXGXIVBQPNUSRY-DDHJBXDOSA-N |
