KEGG   COMPOUND: C03546
Entry
C03546                      Compound                               
Name
myo-Inositol 4-phosphate;
D-myo-Inositol 4-phosphate;
1D-myo-Inositol 4-phosphate;
1D-myo-Inositol 4-monophosphate;
Inositol 4-phosphate
Formula
C6H13O9P
Exact mass
260.0297
Mol weight
260.14
Structure
Reaction
Pathway
map00562  Inositol phosphate metabolism
map01100  Metabolic pathways
map04070  Phosphatidylinositol signaling system
Enzyme
3.1.3.25        3.1.3.57
Other DBs
CAS: 46495-39-0
PubChem: 6349
ChEBI: 166491 18384
PDB-CCD: I4D[PDBj]
NIKKAJI: J392.708C
KCF data

ATOM        16
            1   P1b P    20.9546  -16.1561
            2   O2b O    19.5836  -16.1561
            3   O1c O    22.3317  -16.1561
            4   O1c O    20.9546  -14.7789
            5   O1c O    20.9546  -17.5270
            6   C1y C    18.3959  -15.4738
            7   C1y C    18.3959  -14.0839
            8   C1y C    17.1955  -16.1751
            9   C1y C    17.1955  -13.4017
            10  O1a O    19.5836  -13.3953
            11  C1y C    16.0015  -15.4738
            12  O1a O    17.1892  -17.5523
            13  C1y C    16.0015  -14.0839
            14  O1a O    17.1892  -12.1643
            15  O1a O    14.8075  -16.1561
            16  O1a O    14.7400  -13.3194
BOND        16
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     1   5 2
            5     6   2 1 #Down
            6     6   7 1
            7     6   8 1
            8     7   9 1
            9     7  10 1 #Up
            10    8  11 1
            11    8  12 1 #Up
            12    9  13 1
            13    9  14 1 #Down
            14   11  15 1 #Up
            15   13  16 1 #Up
            16   11  13 1

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