KEGG   COMPOUND: C17479
Entry
C17479                      Compound                               
Name
Fraxidin;
8-Hydroxy-6,7-dimethoxy-2H-1-benzopyran-2-one
Formula
C11H10O5
Exact mass
222.0528
Mol weight
222.1941
Structure
Other DBs
CAS: 525-21-3
PubChem: 96023827
ChEBI: 81120
KNApSAcK: C00019875
NIKKAJI: J11.697A
KCF data

ATOM        16
            1   C8y C    25.7964  -20.4710
            2   C8y C    25.7964  -21.8732
            3   C8x C    27.0106  -22.5743
            4   C8y C    28.2250  -21.8732
            5   C8y C    28.2250  -20.4710
            6   C8y C    27.0106  -19.7699
            7   C8x C    29.4393  -22.5743
            8   C8x C    30.6536  -21.8732
            9   C8y C    30.6536  -20.4710
            10  O7x O    29.4393  -19.7699
            11  O1a O    27.0106  -18.3679
            12  O2a O    24.5821  -19.7699
            13  O2a O    24.5821  -22.5743
            14  O6a O    31.8530  -19.7784
            15  C1a C    23.3848  -20.4614
            16  C1a C    23.3457  -21.8610
BOND        17
            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     4   7 1
            8     7   8 2
            9     8   9 1
            10    9  10 1
            11    5  10 1
            12    6  11 1
            13    1  12 1
            14    2  13 1
            15    9  14 2
            16   12  15 1
            17   13  16 1

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