C00247


Entry
C00247                      Compound                               
Name
L-Sorbose;
L-xylo-Hexulose
Formula
C6H12O6
Exact mass
180.0634
Mol weight
180.1559
Structure
Comment
Sorbose [CPD:C01452]
D-Sorbose [CPD:C00764]
Reaction
R01694 R01695 R01696 R01697 R02925 R04076 R07145 R07346
R09551
Pathway
map00051  Fructose and mannose metabolism
map01100  Metabolic pathways
Enzyme
1.1.1.14        1.1.1.123       1.1.1.289       1.1.3.11        
1.1.99.12       1.1.99.21       1.1.99.32       2.7.1.206
Brite
Compounds with biological roles [BR:br08001]
 Carbohydrates
  Monosaccharides
   Ketoses
    C00247  L-Sorbose
Other DBs
CAS: 87-79-6
PubChem: 3546
ChEBI: 48649
PDB-CCD: SOE[PDBj]
3DMET: B04653
NIKKAJI: J4.280C
KCF data

ATOM        12
            1   C1z C    26.2968  -14.4371
            2   C1y C    26.2968  -15.8376
            3   O2x O    25.0888  -13.7368
            4   C1b C    27.5108  -13.7368
            5   O1a O    27.2832  -15.4233
            6   C1y C    25.0888  -16.5379
            7   O1a O    27.5108  -16.5379
            8   C1x C    23.8692  -14.4371
            9   O1a O    28.5730  -14.6471
            10  C1y C    23.8692  -15.8376
            11  O1a O    25.0888  -17.9386
            12  O1a O    22.6612  -16.5379
BOND        12
            1     1   2 1
            2     1   3 1
            3     1   4 1 #Either
            4     1   5 1
            5     2   6 1
            6     2   7 1 #Up
            7     3   8 1
            8     4   9 1
            9     6  10 1
            10    6  11 1 #Down
            11   10  12 1 #Up
            12    8  10 1