KEGG   COMPOUND: C22599
Entry
C22599                      Compound                               
Name
Xanthone
Formula
C13H8O2
Exact mass
196.0524
Mol weight
196.2014
Structure
Other DBs
CAS: 90-47-1
LinkDB
KCF data

ATOM        15
            1   C8x C    13.5100  -13.7900
            2   C8x C    13.5100  -15.1900
            3   C8x C    14.7224  -15.8900
            4   C8y C    15.9349  -15.1900
            5   C8y C    15.9349  -13.7900
            6   C8x C    14.7224  -13.0900
            7   O2x O    17.1473  -15.8900
            8   C8y C    18.3597  -15.1900
            9   C8y C    18.3597  -13.7900
            10  C8y C    17.1473  -13.0900
            11  C8x C    19.5722  -15.8900
            12  C8x C    20.7846  -15.1900
            13  C8x C    20.7846  -13.7900
            14  C8x C    19.5722  -13.0900
            15  O5x O    17.1473  -11.6900
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 1
            9     8   9 1
            10    9  10 1
            11    5  10 1
            12    8  11 2
            13   11  12 1
            14   12  13 2
            15   13  14 1
            16    9  14 2
            17   10  15 2

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