KEGG   COMPOUND: C19891Help
Entry
C19891                      Compound                               

Name
1D-chiro-Inositol;
1,2,4/3,5,6-Cyclohexane-1,2,3,4,5,6-hexol;
(+)-Inositol
Formula
C6H12O6
Exact mass
180.0634
Mol weight
180.1559
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00562  Inositol phosphate metabolism
map01100  Metabolic pathways
map01120  Microbial metabolism in diverse environments
Enzyme
Other DBs
CAS: 643-12-9
PubChem: 135626357
ChEMBL: CHEMBL1231671
PDB-CCD: CBU[PDBj]
KCF data Show

ATOM        12
            1   C1y C    24.0800  -18.1300
            2   C1y C    24.0800  -19.5300
            3   C1y C    25.2924  -20.2300
            4   C1y C    26.5049  -19.5300
            5   C1y C    26.5049  -18.1300
            6   C1y C    25.2924  -17.4300
            7   O1a O    25.2924  -16.0302
            8   O1a O    22.8676  -17.4300
            9   O1a O    27.7360  -20.2410
            10  O1a O    27.7360  -17.4190
            11  O1a O    25.2924  -21.6298
            12  O1a O    22.8676  -20.2300
BOND        12
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     1   6 1
            7     6   7 1 #Down
            8     1   8 1 #Down
            9     4   9 1 #Down
            10    5  10 1 #Up
            11    3  11 1 #Up
            12    2  12 1 #Up

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