Chemical Component Summary

Name(1R,5S,6S,7R,8S)-1-THIONIABICYCLO[4.3.0]NONAN-5,7,8-TRIOL
Identifiers(1R,2S,4R,8S,8aS)-1,2,3,5,6,7,8,8a-octahydrothieno[1,2-a]thiopyran-4-ium-1,2,8-triol
FormulaC8 H15 O3 S
Molecular Weight191.268
TypeNON-POLYMER
Isomeric SMILESC1C[C@@H]([C@H]2[C@@H]([C@@H](C[S@+]2C1)O)O)O
InChIInChI=1S/C8H15O3S/c9-5-2-1-3-12-4-6(10)7(11)8(5)12/h5-11H,1-4H2/q+1/t5-,6+,7+,8-,12+/m0/s1
InChIKeyYXHBFMXISHCSIQ-OZFRBSTCSA-N

Chemical Details

Formal Charge1
Atom Count27
Chiral Atom Count0
Bond Count28
Aromatic Bond Count0