| PDB CCD ID: | A1H0P |
| Number of entries in BioLiP: | 0 |
| Chemical formula: | C6 H12 O9 S |
| InChI: | InChI=1S/C6H12O9S/c7-1-2-3(8)5(15-16(11,12)13)4(9)6(10)14-2/h2-10H,1H2,(H,11,12,13)/t2-,3-,4+,5+,6+/m1/s1 |
| InChIKey: | HHRMGTRTCHNCRO-PQMKYFCFSA-N |
| SMILES: | | Software | SMILES |
|---|
| OpenEye OEToolkits 2.0.7 | C([C@@H]1[C@H]([C@@H]([C@@H]([C@H](O1)O)O)OS(=O)(=O)O)O)O | | CACTVS 3.385 | OC[C@H]1O[C@H](O)[C@@H](O)[C@@H](O[S](O)(=O)=O)[C@@H]1O | | CACTVS 3.385 | OC[CH]1O[CH](O)[CH](O)[CH](O[S](O)(=O)=O)[CH]1O | | OpenEye OEToolkits 2.0.7 | C(C1C(C(C(C(O1)O)O)OS(=O)(=O)O)O)O |
|
| Name: | 3-O-sulfo-alpha-D-mannopyranose;
[(2R,3R,4S,5S,6S)-2-(hydroxymethyl)-3,5,6-tris(oxidanyl)oxan-4-yl] hydrogen sulfate |
zhanggroup.org