KEGG   COMPOUND: C12331
Entry
C12331                      Compound                               
Name
2,3,9,10-Tetrahydroxyberberine
Formula
C17H14NO4
Exact mass
296.0923
Mol weight
296.2974
Structure
Other DBs
PubChem: 582721
ChEBI: 31070
NIKKAJI: J1.648.556J
LinkDB
KCF data

ATOM        22
            1   C8y C    28.0554  -20.2889
            2   C8y C    26.9099  -20.9843
            3   N5y N    29.2768  -20.9726 #+
            4   C8x C    28.0437  -18.8923
            5   C8y C    26.8457  -22.3869
            6   C8x C    25.6360  -20.2830
            7   C8x C    30.4806  -20.2655
            8   C1x C    29.2826  -22.3811
            9   C8y C    29.2534  -18.1793
            10  C1x C    28.0671  -23.0881
            11  C8x C    25.6360  -23.0941
            12  C8y C    24.4146  -20.9843
            13  C8y C    30.4689  -18.8689
            14  C8x C    29.2417  -16.7825
            15  C8y C    24.4146  -22.3869
            16  O1a O    23.2049  -20.2830
            17  C8y C    31.6729  -18.1559
            18  C8x C    30.4398  -16.0812
            19  O1a O    23.2049  -23.0941
            20  C8y C    31.6552  -16.7591
            21  O1a O    32.8883  -18.8455
            22  O1a O    32.8592  -16.0520
BOND        25
            1     1   2 1
            2     1   3 1
            3     1   4 2
            4     2   5 2
            5     2   6 1
            6     3   7 2
            7     3   8 1
            8     4   9 1
            9     5  10 1
            10    5  11 1
            11    6  12 2
            12    7  13 1
            13    9  14 1
            14   11  15 2
            15   12  16 1
            16   13  17 1
            17   14  18 2
            18   15  19 1
            19   17  20 2
            20   17  21 1
            21   20  22 1
            22    8  10 1
            23    9  13 2
            24   12  15 1
            25   18  20 1

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