KEGG   COMPOUND: C16427Help
Entry
C16427                      Compound                               

Name
Isopentenyl adenosine
Formula
C15H21N5O4
Exact mass
335.1594
Mol weight
335.3583
Structure
Mol fileKCF fileDB search
Remark
Same as: D05726
Reaction
Pathway
map00908  Zeatin biosynthesis
map01110  Biosynthesis of secondary metabolites
Other DBs
CAS: 7724-76-7
PubChem: 47205724
ChEBI: 62881
ChEMBL: CHEMBL452867
KNApSAcK: C00007324
PDB-CCD: ZIR[PDBj]
NIKKAJI: J8.966D
KCF data Show

ATOM        24
            1   N4y N    28.9100  -17.9900
            2   C8y C    27.6500  -17.6400
            3   C1y C    28.2100  -19.9500
            4   C8x C    29.7500  -16.9400
            5   C8y C    27.6500  -16.2400
            6   N5x N    26.4600  -18.2700
            7   O2x O    27.0900  -19.1100
            8   C1y C    27.7900  -21.2100
            9   N5x N    28.9100  -15.8200
            10  C8y C    26.4600  -15.5400
            11  C8x C    25.2700  -17.6400
            12  C1y C    25.9700  -19.9500
            13  C1y C    26.3900  -21.2100
            14  O1a O    28.6300  -22.2600
            15  N5x N    25.2700  -16.2400
            16  N1b N    26.4600  -14.2100
            17  O1a O    25.6200  -22.2600
            18  C1b C    25.3400  -13.5100
            19  C2b C    24.2200  -14.2100
            20  C2c C    23.0300  -13.5100
            21  C1a C    21.8400  -14.2100
            22  C1a C    23.0300  -12.1800
            23  C1b C    24.7576  -19.2500
            24  O1a O    23.5451  -19.9500
BOND        26
            1     1   2 1
            2     3   1 1 #Up
            3     1   4 1
            4     2   5 2
            5     2   6 1
            6     3   7 1
            7     3   8 1
            8     4   9 2
            9     5  10 1
            10    6  11 2
            11    7  12 1
            12    8  13 1
            13    8  14 1 #Down
            14   10  15 2
            15   10  16 1
            16   13  17 1 #Down
            17   16  18 1
            18   18  19 1
            19   19  20 2
            20   20  21 1
            21   20  22 1
            22    5   9 1
            23   11  15 1
            24   12  13 1
            25   12  23 1 #Up
            26   23  24 1

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