Ketcher 08202113022D 1   1.00000     0.00000     0

 11 10  0     1  0            999 V2000
   10.6805  -11.7074    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.5464  -14.2074    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8146  -14.2074    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.2785  -13.2075    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0824  -13.2075    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.6805  -12.7074    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5464  -13.2075    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8146  -13.2075    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4125  -12.7074    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9485  -12.7074    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4125  -11.7074    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  6  1  1  1     0  0
  7  2  1  6     0  0
  8  3  1  1     0  0
  9  4  1  0     0  0
  5 10  1  0     0  0
  6  7  1  0     0  0
  6  8  1  0     0  0
  7  9  1  0     0  0
  8 10  1  0     0  0
  9 11  1  6     0  0
M  END
> <ID>
CHEBI:144571

> <NAME>
D-fucitol

> <DEFINITION>
The D-enantiomer of fucitol.

> <STAR>
3

> <SYNONYM>
D-Fuc-ol; 1-deoxy-L-galactitol; (2S,3R,4S,5R)-hexane-1,2,3,4,5-pentol

> <IUPAC_NAME>
6-deoxy-D-galactitol

> <FORMULA>
C6H14O5

> <MASS>
166.173

> <MONOISOTOPIC_MASS>
166.08412

> <CHARGE>
0

> <SMILES>
C[C@@H](O)[C@H](O)[C@H](O)[C@@H](O)CO

> <INCHI>
InChI=1S/C6H14O5/c1-3(8)5(10)6(11)4(9)2-7/h3-11H,2H2,1H3/t3-,4+,5+,6-/m1/s1

> <INCHIKEY>
SKCKOFZKJLZSFA-DPYQTVNSSA-N

> <CAS_REGISTRY_NUMBER>
37114-30-0

> <KNAPSACK_ACCESSION>
C00053179

> <PUBMED_CITATION>
7042910

$$$$