KEGG   DRUG: Tagatose
Entry
D09007                      Drug                                   
Name
Tagatose (NF)
Formula
C6H12O6
Exact mass
180.0634
Mol weight
180.1559
Structure
Simcomp
Efficacy
Pharmaceutic aid (sweetener)
Other DBs
CAS: 87-81-0
PubChem: 96025690
PDB-CCD: TAG[PDBj]
LigandBox: D09007
NIKKAJI: J9.874D
KCF data

ATOM        12
            1   O1a O    16.5200  -15.6800
            2   C1b C    17.7324  -14.9800
            3   C1c C    18.9449  -15.6800
            4   C1c C    20.1573  -14.9800
            5   C1c C    21.3697  -15.6800
            6   C5a C    22.5822  -14.9800
            7   C1b C    23.7946  -15.6800
            8   O1a O    25.0070  -14.9800
            9   O1a O    18.9449  -17.0798
            10  O1a O    20.1573  -13.5800
            11  O1a O    21.3697  -17.0799
            12  O5a O    22.5822  -13.5803
BOND        11
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     6   7 1
            7     7   8 1
            8     3   9 1 #Down
            9     4  10 1 #Down
            10    5  11 1 #Up
            11    6  12 2

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Drug (1)   
   LigandBox (1)   
Chemical substance (4)   
   PubChem (1)   
   HMDB (1)   
   NIKKAJI (1)   
   PDB-CCD (1)   
All databases (5)   

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