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1SD

Summary
Name:(1S)-1,5-anhydro-1-sulfamoyl-D-galactitol
Synonyms:(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxane-2-sulfonamide
(1S)-D-Galactopyranosylsulfonamide
Formula:C6 H13 N O7 S
Formal charge:0
Formula weight:243.235 Da
Component type:D-saccharide

Chemical Identifiers

ProgramVersionName
ACDLabs10.04(1S)-1,5-anhydro-1-sulfamoyl-D-galactitol
OpenEye OEToolkits1.5.0(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxane-2-sulfonamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=S(=O)(N)C1OC(C(O)C(O)C1O)CO
SMILES_CANONICALCACTVS3.341N[S](=O)(=O)[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O
SMILESCACTVS3.341N[S](=O)(=O)[CH]1O[CH](CO)[CH](O)[CH](O)[CH]1O
SMILES_CANONICALOpenEye OEToolkits1.5.0C([C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)S(=O)(=O)N)O)O)O)O
SMILESOpenEye OEToolkits1.5.0C(C1C(C(C(C(O1)S(=O)(=O)N)O)O)O)O
InChIInChI1.03InChI=1S/C6H13NO7S/c7-15(12,13)6-5(11)4(10)3(9)2(1-8)14-6/h2-6,8-11H,1H2,(H2,7,12,13)/t2-,3+,4+,5-,6+/m1/s1
InChIKeyInChI1.03OQMMAWGZUDHRTA-PHYPRBDBSA-N

222415

PDB entries from 2024-07-10

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