MRP
概要
| 表記: | 3-O-methyl-alpha-L-rhamnopyranose |
| 別名: | 3-O-METHYL-ALPHA-L-RHAMNOPYRANOSIDE 6-deoxy-3-O-methyl-alpha-L-mannopyranose; 3-O-methyl-alpha-L-rhamnose; 3-O-methyl-L-rhamnose; 3-O-methyl-rhamnose |
| 組成式: | C7 H14 O5 |
| 電荷: | 0 |
| 化学式量: | 178.183 Da |
| 分子種別: | L-saccharide, alpha linking |
化合物名
| プログラム | バージョン | 表記 |
| ACDLabs | 10.04 | 6-deoxy-3-O-methyl-alpha-L-mannopyranose |
| OpenEye OEToolkits | 1.5.0 | (2R,3R,4R,5S,6S)-4-methoxy-6-methyl-oxane-2,3,5-triol |
| PDB-CARE | 1.0 | a-L-Rhap3OMe |
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(C1C(O)C(OC(O)C1O)C)C |
| SMILES_CANONICAL | CACTVS | 3.341 | CO[C@@H]1[C@@H](O)[C@H](C)O[C@@H](O)[C@@H]1O |
| SMILES | CACTVS | 3.341 | CO[CH]1[CH](O)[CH](C)O[CH](O)[CH]1O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O)O)OC)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | CC1C(C(C(C(O1)O)O)OC)O |
| InChI | InChI | 1.03 | InChI=1S/C7H14O5/c1-3-4(8)6(11-2)5(9)7(10)12-3/h3-10H,1-2H3/t3-,4-,5+,6+,7+/m0/s1 |
| InChIKey | InChI | 1.03 | OEKPKBBXXDGXNB-PAMBMQIZSA-N |
