G1P
Summary
| Name: | 1-O-phosphono-alpha-D-glucopyranose |
| Synonyms: | ALPHA-D-GLUCOSE-1-PHOSPHATE 1-O-phosphono-alpha-D-glucose; 1-O-phosphono-D-glucose; 1-O-phosphono-glucose |
| Formula: | C6 H13 O9 P |
| Formal charge: | 0 |
| Formula weight: | 260.136 Da |
| Component type: | D-saccharide |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 1-O-phosphono-alpha-D-glucopyranose |
| OpenEye OEToolkits | 1.7.0 | [(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] dihydrogen phosphate |
| PDB-CARE | 1.0 | a-D-Glcp1PO3 |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=P(O)(OC1OC(C(O)C(O)C1O)CO)O |
| SMILES_CANONICAL | CACTVS | 3.370 | OC[C@H]1O[C@H](O[P](O)(O)=O)[C@H](O)[C@@H](O)[C@@H]1O |
| SMILES | CACTVS | 3.370 | OC[CH]1O[CH](O[P](O)(O)=O)[CH](O)[CH](O)[CH]1O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)OP(=O)(O)O)O)O)O)O |
| SMILES | OpenEye OEToolkits | 1.7.0 | C(C1C(C(C(C(O1)OP(=O)(O)O)O)O)O)O |
| InChI | InChI | 1.03 | InChI=1S/C6H13O9P/c7-1-2-3(8)4(9)5(10)6(14-2)15-16(11,12)13/h2-10H,1H2,(H2,11,12,13)/t2-,3-,4+,5-,6-/m1/s1 |
| InChIKey | InChI | 1.03 | HXXFSFRBOHSIMQ-VFUOTHLCSA-N |
