ChEBI
  Marvin  11090914592D          

 12 11  0  0  1  0            999 V2000
    4.3754   -2.8827    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0946   -3.2870    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    5.8075   -2.8663    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    6.5267   -3.2705    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    7.2397   -2.8498    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    7.9588   -3.2540    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6748   -3.2962    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1008   -4.1119    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8013   -2.0413    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5329   -4.0955    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2334   -2.0248    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.9650   -4.0790    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  7  1  1  0  0  0  0
  2  1  1  0  0  0  0
  2  8  1  1  0  0  0
  3  2  1  0  0  0  0
  3  9  1  6  0  0  0
  4  3  1  0  0  0  0
  4 10  1  6  0  0  0
  5  4  1  0  0  0  0
  5 11  1  1  0  0  0
  6  5  1  0  0  0  0
 12  6  1  0  0  0  0
M  END
> <ID>
CHEBI:38030

> <NAME>
L-mannitol

> <DEFINITION>
The L-enantiomer of mannitol.

> <STAR>
3

> <IUPAC_NAME>
L-mannitol

> <FORMULA>
C6H14O6

> <MASS>
182.17180

> <MONOISOTOPIC_MASS>
182.07904

> <CHARGE>
0

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

> <INCHI>
InChI=1S/C6H14O6/c7-1-3(9)5(11)6(12)4(10)2-8/h3-12H,1-2H2/t3-,4-,5-,6-/m0/s1

> <INCHIKEY>
FBPFZTCFMRRESA-BXKVDMCESA-N

> <BEILSTEIN_REGISTRY_NUMBER>
1721907

> <CAS_REGISTRY_NUMBER>
643-01-6

> <REAXYS_REGISTRY_NUMBER>
1721907

> <CHEMIDPLUS>
643-01-6

> <NIST_CHEMISTRY_WEBBOOK>
643-01-6

> <PUBMED_CITATION>
17336832; 22515886

$$$$