Summary
Name: | D-GLUCOPYRANOSYLIUM |
Formula: | C6 H11 O5 |
Formal charge: | 1 |
Formula weight: | 163.149 Da |
Component type: | D-SACCHARIDE |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | (3S,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-ylium |
OpenEye OEToolkits | 1.5.0 | (2R,3S,4R,5S)-2-(hydroxymethyl)-3,4,5,6-tetrahydro-2H-pyran-6-ylium-3,4,5-triol |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | OC1C(O)C(O)[CH+]OC1CO |
InChI | InChI | 1.02b | InChI=1/C6H11O5/c7-1-4-6(10)5(9)3(8)2-11-4/h2-10H,1H2/q+1/t3-,4+,5+,6+/m0/s1 |
InChIKey | InChI | 1.02b | UENHGZXMWVWJGF-SLPGGIOYBF |
SMILES_CANONICAL | CACTVS | 3.341 | OC[C@H]1O[CH+][C@H](O)[C@@H](O)[C@@H]1O |
SMILES | CACTVS | 3.341 | OC[CH]1O[CH+][CH](O)[CH](O)[CH]1O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | [CH+]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O |
SMILES | OpenEye OEToolkits | 1.5.0 | [CH+]1C(C(C(C(O1)CO)O)O)O |