D-fucose   

GtoPdb Ligand ID: 4722

2D Structure
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Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 4
Rotatable bonds 4
Topological polar surface area 97.99
Molecular weight 164.07
XLogP -2.19
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
Canonical SMILES O=CC(C(C(C(O)C)O)O)O
Isomeric SMILES O=C[C@@H]([C@H]([C@H]([C@H](O)C)O)O)O
InChI InChI=1S/C6H12O5/c1-3(8)5(10)6(11)4(9)2-7/h2-6,8-11H,1H3/t3-,4+,5+,6-/m1/s1
InChI Key PNNNRSAQSRJVSB-DPYQTVNSSA-N
Classification
Compound class Metabolite or derivative
IUPAC Name
(2R,3S,4S,5R)-2,3,4,5-tetrahydroxyhexanal
Database Links
CAS Registry No. 3615-37-0 (source: Scifinder)
ChEBI CHEBI:48203
GtoPdb PubChem SID 178101433
PubChem CID 94270
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