Ketcher 10231916442D 1   1.00000     0.00000     0

 12 11  0     1  0            999 V2000
    8.0977  -20.2982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2316  -20.7982    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.4278  -20.7982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2938  -20.2982    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.5618  -20.2982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5618  -19.2982    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8297  -20.2982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8297  -19.2982    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.6958  -20.7982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6958  -21.7982    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.9638  -20.7982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9638  -21.7982    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1 11  1  0     0  0
 11  7  1  0     0  0
  7  9  1  0     0  0
  9  5  1  0     0  0
  5  3  1  0     0  0
  1  2  1  0     0  0
  3  4  1  0     0  0
  5  6  2  0     0  0
  7  8  1  6     0  0
  9 10  1  1     0  0
 11 12  1  1     0  0
M  END
> <ID>
CHEBI:145026

> <NAME>
L-psicose

> <DEFINITION>
The L-enantiomer of psicose.

> <STAR>
3

> <SYNONYM>
L-ribo-2-hexulose; L-allulose; L-allulose; (3S,4S,5S)-1,3,4,5,6-pentahydroxyhexan-2-one

> <IUPAC_NAME>
L-psicose

> <FORMULA>
C6H12O6

> <MASS>
180.156

> <MONOISOTOPIC_MASS>
180.06339

> <CHARGE>
0

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

> <INCHI>
InChI=1S/C6H12O6/c7-1-3(9)5(11)6(12)4(10)2-8/h3,5-9,11-12H,1-2H2/t3-,5-,6+/m0/s1

> <INCHIKEY>
BJHIKXHVCXFQLS-ZXEDONINSA-N

> <CAS_REGISTRY_NUMBER>
16354-64-6

> <CHEMIDPLUS>
16354-64-6

> <PUBMED_CITATION>
16243286; 19111643; 25888171; 26020767; 27262904; 27713017

$$$$