KEGG   COMPOUND: C19679
Entry
C19679                      Compound                               

Name
L-Sorbosone;
1-Dehydro-L-sorbose
Formula
C6H10O6
Exact mass
178.0477
Mol weight
178.14
Structure
Reaction
Enzyme
Other DBs
PubChem: 135626147
KCF data

ATOM        12
            1   O1a O     7.4900  -16.4500
            2   C1b C     8.7024  -15.7500
            3   C1c C     9.9149  -16.4500
            4   C1c C    11.1273  -15.7500
            5   C1c C    12.3397  -16.4500
            6   C5a C    13.5522  -15.7500
            7   C4a C    14.7646  -16.4500
            8   O4a O    15.9770  -15.7500
            9   O1a O     9.9149  -17.8500
            10  O1a O    11.1273  -14.3500
            11  O1a O    12.3397  -17.8500
            12  O5a O    13.5522  -14.3503
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 2
            8     3   9 1 #Up
            9     4  10 1 #Up
            10    5  11 1 #Up
            11    6  12 2

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