KEGG   COMPOUND: C08744
Entry
C08744                      Compound                               
Name
Dihydroeuparin;
6-Hydroxytremetone
Formula
C13H14O3
Exact mass
218.0943
Mol weight
218.2485
Structure
Other DBs
CAS: 6906-88-3
PubChem: 10937
ChEBI: 2202
KNApSAcK: C00002399 C00033026
3DMET: B02371
NIKKAJI: J167.366A
LinkDB
KCF data

ATOM        16
            1   C8y C    28.3101  -20.9382
            2   C8y C    28.2460  -19.5346
            3   O2x O    29.6376  -21.3768
            4   C8x C    27.1054  -21.6340
            5   C8x C    27.1054  -18.8328
            6   C1x C    29.6493  -19.1078
            7   C1y C    30.4681  -20.2422
            8   C8y C    25.8891  -20.9322
            9   C8y C    25.8891  -19.5346
            10  C2c C    31.8658  -20.2481
            11  O1a O    24.6785  -21.6340
            12  C5a C    24.6785  -18.8328
            13  C1a C    32.5616  -21.4644
            14  C2a C    32.5733  -19.0375
            15  O5a O    24.6785  -17.4352
            16  C1a C    23.4680  -19.5346
BOND        17
            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 2
            9     7  10 1 #Down
            10    8  11 1
            11    9  12 1
            12   10  13 1
            13   10  14 2
            14   12  15 2
            15   12  16 1
            16    6   7 1
            17    8   9 1

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