PRD_900050

2-deoxy-2-fluoro-beta-cellobiose

PRD_900050 is described in the Biologically Interesting Molecule Reference Dictionary (BIRD).

The representative PDB ID is 1E0V.

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Chemical Component Summary

Name2-deoxy-2-fluoro-beta-cellobiose
Identifiers(2S,3R,4S,5S,6R)-2-[(2R,3S,4S,5R,6S)-5-fluoro-4,6-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5 -triol
FormulaC12 H21 F O10
Molecular Weight344.288
TypeSACCHARIDE
Isomeric SMILESC([C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)O[C@@H]2[C@H](O[C@@H]([C@@H]([C@H]2O)F)O)CO)O)O)O)O
InChIInChI=1S/C12H21FO10/c13-5-7(17)10(4(2-15)21-11(5)20)23-12-9(19)8(18)6(16)3(1-14)22-12/h3-12,14-20H,1-2H2/t3-,4-,5-,6-,7 -,8+,9-,10-,11+,12+/m1/s1
InChIKeyCHZBROHNUFSPPZ-FINXQLPQSA-N
CompositionPolymer Sequences: G2F-BGC
BIRD classSUBSTRATE ANALOG
Represented AsBRANCHED
Compound Detailsn/a
Descriptionn/a

Chemical Details

Formal Charge0
Atom Count44
Chiral Atom Count10
Bond Count45
Aromatic Bond Count0

Related Resource References

Resource NameReference
PubChem 445187