44S
Summary
| Name: | 2-deoxy-6-O-phosphono-beta-D-lyxo-hexofuranose |
| Synonyms: | tagatose-6-phosphate, bound form 2-deoxy-6-O-phosphono-beta-D-lyxo-hexose; 2-deoxy-6-O-phosphono-D-lyxo-hexose; 2-deoxy-6-O-phosphono-lyxo-hexose |
| Formula: | C6 H13 O8 P |
| Formal charge: | 0 |
| Formula weight: | 244.136 Da |
| Component type: | D-saccharide, beta linking |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 2-deoxy-6-O-phosphono-beta-D-lyxo-hexofuranose |
| OpenEye OEToolkits | 1.7.6 | [(2R)-2-[(2R,3R,5R)-3,5-bis(oxidanyl)oxolan-2-yl]-2-oxidanyl-ethyl] dihydrogen phosphate |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=P(O)(O)OCC(O)C1OC(O)CC1O |
| InChI | InChI | 1.03 | InChI=1S/C6H13O8P/c7-3-1-5(9)14-6(3)4(8)2-13-15(10,11)12/h3-9H,1-2H2,(H2,10,11,12)/t3-,4-,5-,6-/m1/s1 |
| InChIKey | InChI | 1.03 | YKPKUODDXPUHGL-KVTDHHQDSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O[C@H]1C[C@@H](O)[C@@H](O1)[C@H](O)CO[P](O)(O)=O |
| SMILES | CACTVS | 3.385 | O[CH]1C[CH](O)[CH](O1)[CH](O)CO[P](O)(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | C1[C@H]([C@@H](O[C@H]1O)[C@@H](COP(=O)(O)O)O)O |
| SMILES | OpenEye OEToolkits | 1.7.6 | C1C(C(OC1O)C(COP(=O)(O)O)O)O |
