KEGG   COMPOUND: C06421
Entry
C06421                      Compound                               
Name
alpha-Cellobiose;
1-beta-D-Glucopyranosyl-4-alpha-D-glucopyranose
Formula
C12H22O11
Exact mass
342.1162
Mol weight
342.2965
Structure
Remark
Same as: G00289
Other DBs
PubChem: 8656
ChEBI: 28676
PDB-CCD: CBK[PDBj]
NIKKAJI: J2.129.875A
LinkDB
KCF data

ATOM        23
            1   C1y C    27.4252  -14.4509
            2   C1y C    27.4252  -13.0479
            3   O2a O    26.2144  -15.1495
            4   C1y C    28.6420  -15.1438
            5   O2x O    28.6420  -12.3492
            6   C1b C    26.2144  -12.3433
            7   C1y C    25.0035  -15.8482
            8   C1y C    29.8531  -14.4509
            9   O1a O    28.6420  -16.5468
            10  C1y C    29.8531  -13.0479
            11  O1a O    25.0035  -13.0479
            12  O2x O    23.7984  -15.1438
            13  C1y C    25.0035  -17.2512
            14  O1a O    31.0640  -15.1438
            15  O1a O    31.0640  -12.3492
            16  C1y C    22.5816  -15.8482
            17  C1y C    23.7984  -17.9441
            18  O1a O    26.2144  -17.9441
            19  C1y C    22.5816  -17.2512
            20  C1b C    21.3648  -15.1438
            21  O1a O    23.7984  -19.3471
            22  O1a O    21.3648  -17.9441
            23  O1a O    20.1539  -15.8482
BOND        24
            1     1   2 1
            2     1   3 1 #Down
            3     1   4 1
            4     2   5 1
            5     2   6 1 #Up
            6     7   3 1 #Up
            7     4   8 1
            8     4   9 1 #Up
            9     5  10 1
            10    6  11 1
            11    7  12 1
            12    7  13 1
            13    8  14 1 #Down
            14   10  15 1 #Down
            15   12  16 1
            16   13  17 1
            17   13  18 1 #Down
            18   16  19 1
            19   16  20 1 #Up
            20   17  21 1 #Up
            21   19  22 1 #Down
            22   20  23 1
            23    8  10 1
            24   17  19 1

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