Marvin  02221317062D          

 11 10  0  0  1  0            999 V2000
    8.2848   -4.6630    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5703   -4.2506    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    6.8558   -4.6631    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    6.1413   -4.2506    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.4269   -4.6632    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7124   -4.2507    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9979   -4.6632    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.8558   -5.4881    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.1413   -3.4256    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4269   -5.4882    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.5703   -3.4256    0.0000 O   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
  3  8  1  6  0  0  0
  4  9  1  6  0  0  0
  5 10  2  0  0  0  0
  2 11  1  1  0  0  0
M  END
> <ID>
CHEBI:17897

> <NAME>
L-rhamnulose

> <DEFINITION>
A deoxyketohexose consisting of L-fructose lacking the 6-hydroxy group.

> <STAR>
3

> <SECONDARY_ID>
CHEBI:21380; CHEBI:6293; CHEBI:13161; CHEBI:58316

> <SYNONYM>
L-rhamnulose; L-rhamnulose; L-Rhamnulose; 6-deoxy-L-arabino-hex-2-ulose

> <IUPAC_NAME>
6-deoxy-L-fructose

> <FORMULA>
C6H12O5

> <MASS>
164.15650

> <MONOISOTOPIC_MASS>
164.06847

> <CHARGE>
0

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

> <INCHI>
InChI=1S/C6H12O5/c1-3(8)5(10)6(11)4(9)2-7/h3,5-8,10-11H,2H2,1H3/t3-,5-,6-/m0/s1

> <INCHIKEY>
QZNPNKJXABGCRC-FUTKDDECSA-N

> <CAS_REGISTRY_NUMBER>
14807-05-7

> <REAXYS_REGISTRY_NUMBER>
1723712

> <KEGG_COMPOUND_ACCESSION>
C00861

> <KNAPSACK_ACCESSION>
C00019652

> <METACYC_ACCESSION>
RHAMNULOSE

> <PUBMED_CITATION>
13825387; 20516598; 23070627

$$$$