KEGG   COMPOUND: C11526Help
Entry
C11526                      Compound                               

Name
5-PP-InsP5;
5-Diphosphoinositol pentakisphosphate;
1D-myo-Inositol 5-diphosphate pentakisphosphate;
1D-myo-Inositol 5-diphosphate 1,2,3,4,6-pentakisphosphate
Formula
C6H19O27P7
Exact mass
739.8277
Mol weight
740.0152
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map04070  Phosphatidylinositol signaling system
Enzyme
2.7.4.21        2.7.4.24        3.6.1.52
Other DBs
PubChem: 13694
ChEBI: 30164
ChEMBL: CHEMBL1241856
PDB-CCD: I7P[PDBj]
NIKKAJI: J2.774.881C
KCF data Show

ATOM        40
            1   O1c O    32.6238  -25.6181
            2   P1b P    34.0134  -25.6123
            3   O1c O    35.3995  -25.6123
            4   O2b O    34.0134  -24.2251
            5   O1c O    34.0134  -26.9996
            6   P1b P    36.5829  -18.5931
            7   O2b O    36.5771  -19.9763
            8   O1c O    35.1982  -18.5989
            9   O1c O    36.5771  -17.2015
            10  O1c O    37.9745  -18.5931
            11  O2b O    36.5771  -25.5271
            12  P1b P    39.2170  -19.9616
            13  O2b O    39.2112  -21.3450
            14  O1c O    37.8324  -19.9673
            15  O1c O    39.2112  -18.5700
            16  O2c O    40.6086  -19.9616
            17  C1y C    37.7889  -22.0385
            18  C1y C    37.7889  -23.4333
            19  C1y C    36.5771  -21.3597
            20  C1y C    36.5771  -24.1438
            21  O2b O    38.9891  -24.1321
            22  C1y C    35.3897  -22.0385
            23  C1y C    35.3897  -23.4333
            24  P1b P    40.3749  -24.1264
            25  O2b O    34.1811  -21.3456
            26  O1c O    41.7584  -24.1264
            27  O1c O    40.3749  -22.7430
            28  O1c O    40.3749  -25.5178
            29  P1b P    32.7979  -21.3340
            30  O1c O    31.4063  -21.3340
            31  O1c O    32.8036  -19.9423
            32  O1c O    32.7920  -22.7172
            33  P1b P    36.5771  -26.9271
            34  O1c O    36.5771  -28.3271
            35  O1c O    37.9771  -26.9271
            36  O1c O    35.1771  -26.9271
            37  P1b P    42.0086  -19.9616
            38  O1c O    43.4086  -19.9616
            39  O1c O    42.0086  -18.5616
            40  O1c O    42.0086  -21.3616
BOND        40
            1     2   5 1
            2     6   7 1
            3     6   8 1
            4     6   9 1
            5     6  10 2
            6     1   2 1
            7     2   3 2
            8     2   4 1
            9    12  13 1
            10   12  14 2
            11   12  15 1
            12   12  16 1
            13   17  13 1 #Up
            14   17  18 1
            15   17  19 1
            16   18  20 1
            17   18  21 1 #Down
            18   19  22 1
            19   19   7 1 #Down
            20   20  23 1
            21   20  11 1 #Up
            22   21  24 1
            23   22  25 1 #Up
            24   23   4 1 #Up
            25   24  26 1
            26   24  27 1
            27   24  28 2
            28   25  29 1
            29   29  30 1
            30   29  31 1
            31   29  32 2
            32   22  23 1
            33   11  33 1
            34   33  34 1
            35   33  35 1
            36   33  36 2
            37   16  37 1
            38   37  38 2
            39   37  39 1
            40   37  40 1

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