ChEBI
  Marvin  03051215592D          

 17 16  0  0  1  0            999 V2000
    5.5472   -8.6704    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5472   -9.4954    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    5.5472  -10.3204    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.5472  -11.1454    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5472  -11.9704    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    5.5472  -12.7954    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2616   -8.2579    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7222   -9.4954    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3722   -9.4954    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7222  -10.3204    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.3722  -10.3204    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7222  -11.1454    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3722  -11.1454    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7222  -11.9704    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3722  -11.9704    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9050   -9.8450    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9993  -10.7329    0.0000 C   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  1  2  0  0  0  0
  2  8  1  1  0  0  0
  2  9  1  1  0  0  0
  3 10  1  1  0  0  0
  3 11  1  1  0  0  0
  4 12  1  1  0  0  0
  4 13  1  1  0  0  0
  5 14  1  1  0  0  0
  5 15  1  1  0  0  0
 16 10  1  0  0  0  0
 17 10  1  0  0  0  0
M  END
> <ID>
CHEBI:32540

> <NAME>
desosamine

> <STAR>
3

> <SYNONYM>
D-xylo-Hexose, 3,4,6-trideoxy-3-(dimethylamino)-

> <IUPAC_NAME>
3,4,6-trideoxy-3-dimethylamino-D-xylo-hexose

> <FORMULA>
C8H17NO3

> <MASS>
175.22550

> <MONOISOTOPIC_MASS>
175.12084

> <CHARGE>
0

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

> <INCHI>
InChI=1S/C8H17NO3/c1-6(11)4-7(9(2)3)8(12)5-10/h5-8,11-12H,4H2,1-3H3/t6-,7+,8+/m1/s1

> <INCHIKEY>
VTJCSBJRQLZNHE-CSMHCCOUSA-N

> <BEILSTEIN_REGISTRY_NUMBER>
2412240

> <CAS_REGISTRY_NUMBER>
5779-39-5

> <CHEMIDPLUS>
5779-39-5

$$$$