KEGG   COMPOUND: C12398
Entry
C12398                      Compound                               

Name
8-O-Methyltetrangulol
Formula
C20H14O4
Exact mass
318.0892
Mol weight
318.3228
Structure
Reaction
Pathway
map01057  Biosynthesis of type II polyketide products
Other DBs
PubChem: 582788
ChEBI: 31145
ChEMBL: CHEMBL2152478
3DMET: B04481
NIKKAJI: J326.580C
KCF data

ATOM        24
            1   C8y C    27.3753  -17.8218
            2   C8y C    26.0870  -18.5703
            3   C8y C    26.0879  -20.0560
            4   C8x C    27.3776  -20.7929
            5   C8y C    28.5959  -20.0539
            6   C8x C    28.6650  -18.5685
            7   C8y C    24.7985  -16.3346
            8   C8y C    24.7985  -17.8218
            9   C8x C    27.3796  -16.3346
            10  C8x C    26.0891  -15.5860
            11  C8x C    20.3363  -17.8409
            12  C8x C    21.4447  -18.4755
            13  C8y C    22.5627  -17.8314
            14  C5x C    23.6805  -18.4755
            15  C8x C    20.3417  -16.3439
            16  C8y C    21.4352  -15.6997
            17  C8y C    22.5627  -16.3346
            18  C5x C    23.6805  -15.6902
            19  O2a O    21.4259  -14.4019
            20  O5x O    23.6712  -14.3923
            21  O5x O    23.6871  -19.7640
            22  O1a O    24.7889  -20.7777
            23  C1a C    29.9428  -20.7777
            24  C1a C    20.2119  -13.7126
BOND        27
            1    11  12 1
            2     6   1 1
            3    12  13 2
            4    13  14 1
            5    14   8 1
            6     1   2 2
            7    11  15 2
            8     2   3 1
            9    15  16 1
            10    3   4 2
            11   16  17 2
            12    7   8 2
            13   17  18 1
            14   18   7 1
            15    8   2 1
            16   16  19 1
            17    1   9 1
            18   18  20 2
            19   13  17 1
            20    9  10 2
            21   14  21 2
            22   10   7 1
            23    3  22 1
            24    4   5 1
            25    5  23 1
            26    5   6 2
            27   19  24 1

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