ChEBI
  Marvin  01241316122D          

 10  9  0  0  1  0            999 V2000
    4.2735   -2.6350    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9827   -3.0565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7026   -2.6468    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    6.4118   -3.0683    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    7.1318   -2.6587    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5535   -3.0446    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.9827   -3.8815    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7026   -1.8218    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4118   -3.8933    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1318   -1.8337    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  6  1  1  0  0  0  0
  2  1  1  0  0  0  0
  7  2  2  0  0  0  0
  3  2  1  0  0  0  0
  3  8  1  6  0  0  0
  4  3  1  0  0  0  0
  4  9  1  1  0  0  0
  5  4  1  0  0  0  0
 10  5  1  0  0  0  0
M  END
> <ID>
CHEBI:17173

> <NAME>
D-ribulose

> <DEFINITION>
The D-stereoisomer of ribulose.

> <STAR>
3

> <SECONDARY_ID>
CHEBI:4241; CHEBI:13016; CHEBI:21086

> <SYNONYM>
D-Rul; D-ribulose; D-Ribulose; D-Riboketose; D-erythro-Pent-2-ulose; D-erythro-2-Pentulose; D-Arabinulose; D-Arabinoketose

> <IUPAC_NAME>
D-ribulose; D-erythro-pent-2-ulose

> <FORMULA>
C5H10O5

> <MASS>
150.12990

> <MONOISOTOPIC_MASS>
150.05282

> <CHARGE>
0

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

> <INCHI>
InChI=1S/C5H10O5/c6-1-3(8)5(10)4(9)2-7/h3,5-8,10H,1-2H2/t3-,5-/m1/s1

> <INCHIKEY>
ZAQJHHRNXZUBTE-NQXXGFSBSA-N

> <CAS_REGISTRY_NUMBER>
488-84-6

> <REAXYS_REGISTRY_NUMBER>
1723050

> <CHEMIDPLUS>
488-84-6

> <KEGG_COMPOUND_ACCESSION>
C00309

> <KNAPSACK_ACCESSION>
C00001131

> <METACYC_ACCESSION>
D-RIBULOSE

> <PDBECHEM_ACCESSION>
RBL

> <PUBMED_CITATION>
22344653; 24391356; 4928018

$$$$