R7R

sulfoquinovose

Created:2023-08-30
Last modified:  2023-12-27

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Chemical Details

Formal Charge0
Atom Count27
Chiral Atom Count5
Bond Count27
Aromatic Bond Count0
2D diagram of R7R

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Chemical Component Summary

Namesulfoquinovose
Synonyms[(2~{S},3~{S},4~{S},5~{R},6~{S})-3,4,5,6-tetrakis(oxidanyl)oxan-2-yl]methanesulfonic acid
Systematic Name (OpenEye OEToolkits)[(2~{S},3~{S},4~{S},5~{R},6~{S})-3,4,5,6-tetrakis(oxidanyl)oxan-2-yl]methanesulfonic acid
FormulaC6 H12 O8 S
Molecular Weight244.22
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESCACTVS3.385O[CH]1O[CH](C[S](O)(=O)=O)[CH](O)[CH](O)[CH]1O
SMILESOpenEye OEToolkits2.0.7C(C1C(C(C(C(O1)O)O)O)O)S(=O)(=O)O
Canonical SMILESCACTVS3.385 O[C@H]1O[C@H](C[S](O)(=O)=O)[C@@H](O)[C@H](O)[C@H]1O
Canonical SMILESOpenEye OEToolkits2.0.7 C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O)O)O)O)S(=O)(=O)O
InChIInChI1.06 InChI=1S/C6H12O8S/c7-3-2(1-15(11,12)13)14-6(10)5(9)4(3)8/h2-10H,1H2,(H,11,12,13)/t2-,3-,4+,5-,6+/m1/s1
InChIKeyInChI1.06 QFBWOLBPVQLZEH-DVKNGEFBSA-N

Related Resource References

Resource NameReference
PubChem 25201702
ChEBI CHEBI:145350