L6S
Summary
Name: | 6-O-sulfo-alpha-L-galactopyranose |
Synonyms: | 6-O-sulfo-alpha-L-galactose 6-O-sulfo-L-galactose; 6-O-sulfo-galactose |
Formula: | C6 H12 O9 S |
Formal charge: | 0 |
Formula weight: | 260.219 Da |
Component type: | L-saccharide, alpha linking |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 11.02 | 6-O-sulfo-alpha-L-galactopyranose |
OpenEye OEToolkits | 1.6.1 | [(2S,3S,4R,5S,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methyl hydrogen sulfate |
GMML | 1.0 | LGalp[6S]a |
GMML | 1.0 | 6-sulfo-a-L-galactopyranose |
PDB-CARE | 1.0 | a-L-Galp6SO3 |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 11.02 | O=S(=O)(O)OCC1OC(O)C(O)C(O)C1O |
SMILES_CANONICAL | CACTVS | 3.352 | O[C@@H]1O[C@@H](CO[S](O)(=O)=O)[C@@H](O)[C@@H](O)[C@@H]1O |
SMILES | CACTVS | 3.352 | O[CH]1O[CH](CO[S](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)O)O)O)O)OS(=O)(=O)O |
SMILES | OpenEye OEToolkits | 1.7.0 | C(C1C(C(C(C(O1)O)O)O)O)OS(=O)(=O)O |
InChI | InChI | 1.03 | InChI=1S/C6H12O9S/c7-3-2(1-14-16(11,12)13)15-6(10)5(9)4(3)8/h2-10H,1H2,(H,11,12,13)/t2-,3+,4+,5-,6+/m0/s1 |
InChIKey | InChI | 1.03 | OKUVUONOJCDUJY-SXUWKVJYSA-N |