KEGG   COMPOUND: C10053Help
Entry
C10053                      Compound                               

Name
Bellidifolin;
3-Methoxy-1,5,8-trihydroxyxanthone
Formula
C14H10O6
Exact mass
274.0477
Mol weight
274.2256
Structure
Mol fileKCF fileDB search
Brite
Phytochemical compounds [BR:br08003]
 Polyketides
  Pyrones
   Xanthenes
    C10053  Bellidifolin
BRITE hierarchy
Other DBs
CAS: 2798-25-6
PubChem: 12239
ChEBI: 3008
ChEMBL: CHEMBL185776
KNApSAcK: C00002943
3DMET: B03496
NIKKAJI: J83.278B
KCF data Show

ATOM        20
            1   C8y C    24.9030  -15.5640
            2   C8y C    24.8971  -16.9629
            3   O2x O    26.1214  -14.8701
            4   C8x C    23.6904  -14.8644
            5   C8y C    26.1098  -17.6742
            6   C8y C    23.6904  -17.6684
            7   C8y C    27.3339  -15.5756
            8   C8y C    22.4836  -15.5640
            9   C8y C    27.3223  -16.9746
            10  O5x O    26.1039  -19.0792
            11  C8x C    22.4836  -16.9629
            12  O1a O    23.6263  -19.0733
            13  C8y C    28.5523  -14.8877
            14  O2a O    21.2654  -14.8644
            15  C8y C    28.5232  -17.6858
            16  C8x C    29.7533  -15.5930
            17  O1a O    28.5640  -13.4886
            18  C1a C    20.0527  -15.5640
            19  C8x C    29.7417  -16.9922
            20  O1a O    28.5116  -19.0849
BOND        22
            1     1   2 2
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     3   7 1
            7     4   8 2
            8     5   9 1
            9     5  10 2
            10    6  11 2
            11    6  12 1
            12    7  13 1
            13    8  14 1
            14    9  15 1
            15   13  16 2
            16   13  17 1
            17   14  18 1
            18   15  19 2
            19   15  20 1
            20    7   9 2
            21    8  11 1
            22   16  19 1

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