KEGG   COMPOUND: C19891
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
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]
LinkDB
KCF data

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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