KEGG   COMPOUND: C01284
Entry
C01284                      Compound                               
Name
1D-myo-Inositol 1,3,4,5,6-pentakisphosphate;
D-myo-Inositol 1,3,4,5,6-pentakisphosphate;
Inositol 1,3,4,5,6-pentakisphosphate
Formula
C6H17O21P5
Exact mass
579.895
Mol weight
580.0554
Structure
Reaction
Pathway
map00562  Inositol phosphate metabolism
map01100  Metabolic pathways
map04070  Phosphatidylinositol signaling system
Module
M00132  Inositol phosphate metabolism, Ins(1,3,4)P3 => phytate
Enzyme
2.7.1.134       2.7.1.140       2.7.1.151       2.7.1.158
Other DBs
PubChem: 4503
ChEBI: 16322
PDB-CCD: 5MY[PDBj]
3DMET: B01433
NIKKAJI: J493.218H
KCF data

ATOM        32
            1   C1y C    23.8501  -17.9023
            2   C1y C    23.8501  -19.3010
            3   C1y C    25.0613  -20.0003
            4   C1y C    26.2727  -19.3010
            5   C1y C    26.2727  -17.9023
            6   C1y C    25.0613  -17.2030
            7   O2b O    25.0613  -15.8045
            8   O2b O    27.5026  -17.1920
            9   O2b O    22.6389  -17.2030
            10  O1a O    22.6389  -20.0003
            11  O2b O    25.0613  -21.3988
            12  O2b O    27.5026  -20.0113
            13  P1b P    25.0613  -14.4059
            14  O1c O    25.0613  -13.0072
            15  O1c O    26.4600  -14.4059
            16  O1c O    23.6627  -14.4059
            17  P1b P    28.9013  -20.0113
            18  O1c O    30.2999  -20.0113
            19  O1c O    28.9013  -18.6126
            20  O1c O    28.9013  -21.4100
            21  P1b P    27.5026  -15.7933
            22  O1c O    28.9013  -15.7933
            23  O1c O    26.1039  -15.7933
            24  O1c O    27.5026  -14.3947
            25  P1b P    21.2402  -17.2030
            26  O1c O    19.8415  -17.2030
            27  O1c O    21.2402  -15.8043
            28  O1c O    21.2402  -18.6016
            29  P1b P    25.0613  -22.7974
            30  O1c O    26.4600  -22.7974
            31  O1c O    23.6627  -22.7974
            32  O1c O    25.0613  -24.1961
BOND        32
            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     5   8 1 #Up
            9     1   9 1 #Up
            10    2  10 1 #Up
            11    3  11 1 #Up
            12    4  12 1 #Down
            13    7  13 1
            14   13  14 1
            15   13  15 2
            16   13  16 1
            17   12  17 1
            18   17  18 1
            19   17  19 2
            20   17  20 1
            21    8  21 1
            22   21  22 1
            23   21  23 2
            24   21  24 1
            25    9  25 1
            26   25  26 1
            27   25  27 2
            28   25  28 1
            29   11  29 1
            30   29  30 1
            31   29  31 1
            32   29  32 2

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