9RN

3,6-anhydro-alpha-D-galactopyranose

Created:2017-07-03
Last modified:  2024-02-19

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Chemical Details

Formal Charge0
Atom Count21
Chiral Atom Count5
Bond Count22
Aromatic Bond Count0
2D diagram of 9RN

Chemical Component Summary

Name3,6-anhydro-alpha-D-galactopyranose
Synonyms3,6-anhydro-D-galactose
Systematic Name (OpenEye OEToolkits)(1~{R},3~{S},4~{R},5~{S},8~{S})-2,6-dioxabicyclo[3.2.1]octane-3,4,8-triol
FormulaC6 H10 O5
Molecular Weight162.141
TypeD-SACCHARIDE, ALPHA LINKING

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01OC1OC2COC(C2O)C1O
SMILESCACTVS3.385O[CH]1O[CH]2CO[CH]([CH]1O)[CH]2O
SMILESOpenEye OEToolkits2.0.7C1C2C(C(O1)C(C(O2)O)O)O
Canonical SMILESCACTVS3.385 O[C@H]1O[C@@H]2CO[C@H]([C@H]1O)[C@H]2O
Canonical SMILESOpenEye OEToolkits2.0.7 C1[C@@H]2[C@@H]([C@H](O1)[C@H]([C@H](O2)O)O)O
InChIInChI1.06 InChI=1S/C6H10O5/c7-3-2-1-10-5(3)4(8)6(9)11-2/h2-9H,1H2/t2-,3+,4-,5+,6+/m1/s1
InChIKeyInChI1.06 DCQFFOLNJVGHLW-RDQKPOQOSA-N

Related Resource References

Resource NameReference
PubChem 13037720