JFZ

4-nitrophenyl 6-deoxy-alpha-L-galactopyranoside

Created: 2019-02-19
Last modified:  2020-07-17

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Chemical Details

Formal Charge0
Atom Count35
Chiral Atom Count5
Bond Count36
Aromatic Bond Count6
2D diagram of JFZ

Chemical Component Summary

Name4-nitrophenyl 6-deoxy-alpha-L-galactopyranoside
Synonyms4-nitrophenyl-alpha-L-fucose; 4-nitrophenyl 6-deoxy-alpha-L-galactoside; 4-nitrophenyl 6-deoxy-L-galactoside; 4-nitrophenyl 6-deoxy-galactoside
Systematic Name (OpenEye OEToolkits)(2~{S},3~{S},4~{R},5~{S},6~{S})-2-methyl-6-(4-nitrophenoxy)oxane-3,4,5-triol
FormulaC12 H15 N O7
Molecular Weight285.25
TypeL-SACCHARIDE

Chemical Descriptors

TypeProgram Version Descriptor
SMILESCACTVS3.385C[CH]1O[CH](Oc2ccc(cc2)[N+]([O-])=O)[CH](O)[CH](O)[CH]1O
SMILESOpenEye OEToolkits2.0.7CC1C(C(C(C(O1)Oc2ccc(cc2)[N+](=O)[O-])O)O)O
Canonical SMILESCACTVS3.385 C[C@@H]1O[C@@H](Oc2ccc(cc2)[N+]([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)Oc2ccc(cc2)[N+](=O)[O-])O)O)O
InChIInChI1.03 InChI=1S/C12H15NO7/c1-6-9(14)10(15)11(16)12(19-6)20-8-4-2-7(3-5-8)13(17)18/h2-6,9-12,14-16H,1H3/t6-,9+,10+,11-,12-/m0/s1
InChIKeyInChI1.03 YILIDCGSXCGACV-SQKFTNEHSA-N

Related Resource References

Resource NameReference
PubChem 82473
ChEBI CHEBI:90253