Marvin  08021016502D          

 15 14  0  0  1  0            999 V2000
   18.8127   -5.0699    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.5272   -4.6574    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   20.2417   -5.0699    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   20.9561   -4.6574    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   21.6706   -5.0699    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   22.3851   -4.6574    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.0995   -5.0699    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.0982   -4.6574    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.5272   -3.8324    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   20.2417   -5.8949    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   20.9561   -3.8324    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   21.6706   -5.8949    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.8127   -3.4200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.8127   -2.5949    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.0915   -3.8206    0.0000 R#  0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  3  1  0  0  0  0
  5  4  1  0  0  0  0
  6  5  1  0  0  0  0
  7  6  1  0  0  0  0
  8  1  2  0  0  0  0
  2  9  1  6  0  0  0
  3 10  1  1  0  0  0
  4 11  1  1  0  0  0
  5 12  1  6  0  0  0
  9 13  1  0  0  0  0
 13 14  2  0  0  0  0
 13 15  1  0  0  0  0
M  END
> <ID>
CHEBI:16062

> <NAME>
N-acyl-D-mannosamine

> <STAR>
3

> <SECONDARY_ID>
CHEBI:21641; CHEBI:12479; CHEBI:7229; CHEBI:12583; CHEBI:57625

> <SYNONYM>
N-Acyl-D-mannosamine; an N-acyl-D-mannosamine

> <FORMULA>
C7H12NO6R

> <MASS>
206.17330

> <MONOISOTOPIC_MASS>
206.06646

> <CHARGE>
0

> <SMILES>
OC[C@H](O)[C@H](O)[C@@H](O)[C@@H](NC([*])=O)C=O

> <KEGG_COMPOUND_ACCESSION>
C00625

$$$$