KEGG   COMPOUND: C06352
Entry
C06352                      Compound                               
Name
4-O-Methyl-myo-inositol;
1D-4-O-Methyl-myo-inositol
Formula
C7H14O6
Exact mass
194.079
Mol weight
194.1825
Structure
Comment
formerly called "6-O-Methyl-myo-inositol" on old nomenclature system of numbering
Reaction
Enzyme
Other DBs
PubChem: 8588
ChEBI: 18266
NIKKAJI: J12.912G
KCF data

ATOM        13
            1   C1y C    27.5167  -15.3934
            2   C1y C    27.4896  -16.7738
            3   C1y C    26.2891  -14.6381
            4   O2a O    28.7371  -14.7074
            5   C1y C    26.2692  -17.4598
            6   O1a O    28.6829  -17.4681
            7   C1y C    25.0687  -15.3241
            8   O1a O    26.3772  -13.2234
            9   C1a C    29.9304  -15.4017
            10  C1y C    25.0416  -16.7045
            11  O1a O    26.3121  -18.9102
            12  O1a O    23.8754  -14.6298
            13  O1a O    23.8212  -17.3905
BOND        13
            1     1   2 1
            2     1   3 1
            3     1   4 1 #Up
            4     2   5 1
            5     2   6 1 #Down
            6     3   7 1
            7     3   8 1 #Down
            8     4   9 1
            9     5  10 1
            10    5  11 1 #Up
            11    7  12 1 #Down
            12   10  13 1 #Down
            13    7  10 1

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