KEGG   COMPOUND: C16788
Entry
C16788                      Compound                               
Name
Pyriculol
Formula
C14H16O4
Exact mass
248.1049
Mol weight
248.2744
Structure
Other DBs
CAS: 24868-59-5
PubChem: 96023312
ChEBI: 80728
NIKKAJI: J442.037C
LinkDB
KCF data

ATOM        18
            1   C8x C    22.5249  -18.8159
            2   C8x C    22.5249  -20.2147
            3   C8y C    23.7363  -20.9141
            4   C8y C    24.9477  -20.2147
            5   C8y C    24.9477  -18.8159
            6   C8x C    23.7363  -18.1166
            7   C2b C    26.1841  -18.1166
            8   C2b C    27.3955  -18.8159
            9   C1c C    28.6069  -18.1166
            10  C1c C    29.8182  -18.8159
            11  C2b C    31.0296  -18.1166
            12  C2b C    32.2409  -18.8159
            13  C1a C    33.4523  -18.1166
            14  O1a O    23.7363  -22.3126
            15  C4a C    26.1777  -20.9251
            16  O1a O    29.8182  -20.2146
            17  O1a O    28.6069  -16.7178
            18  O4a O    27.3898  -20.2255
BOND        18
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     5   7 1
            8     7   8 2
            9     8   9 1
            10    9  10 1
            11   10  11 1
            12   11  12 2
            13   12  13 1
            14    3  14 1
            15    4  15 1
            16   10  16 1 #Down
            17    9  17 1 #Up
            18   15  18 2

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