KEGG   COMPOUND: C01093
Entry
C01093                      Compound                               

Name
Cellobiono-1,5-lactone;
Cellobiose-1,5-lactone;
Cellobionolactone
Formula
C12H20O11
Exact mass
340.1006
Mol weight
340.2806
Structure
Remark
Same as: G10590
Reaction
Enzyme
Other DBs
CAS: 52762-22-8
PubChem: 4328
ChEBI: 17863
NIKKAJI: J961.197E
KCF data

ATOM        23
            1   C1y C    24.4199  -14.7328
            2   C1y C    24.4199  -13.3952
            3   O2a O    22.8417  -16.0028
            4   C1y C    25.5850  -15.4048
            5   O7x O    25.5850  -12.7231
            6   C1b C    23.2732  -12.7231
            7   C1y C    20.7950  -16.3417
            8   C1y C    26.7563  -14.7328
            9   O1a O    25.5850  -16.8126
            10  C7x C    26.7563  -13.3952
            11  O1a O    22.2499  -13.5863
            12  O2x O    19.6237  -15.6699
            13  C1y C    20.7950  -17.6795
            14  O1a O    27.9151  -15.4048
            15  O6a O    27.8451  -12.7931
            16  C1y C    18.4647  -16.3417
            17  C1y C    19.6237  -18.3576
            18  O1a O    21.9601  -18.3576
            19  C1y C    18.4647  -17.6795
            20  C1b C    17.3182  -15.6760
            21  O1a O    19.6237  -19.7654
            22  O1a O    17.3182  -18.3576
            23  O1a O    16.2886  -16.5391
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 2
            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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