KEGG   COMPOUND: C02080
Entry
C02080                      Compound                               

Name
Stipitatonate
Formula
C9H4O6
Exact mass
208.0008
Mol weight
208.1245
Structure
Reaction
Enzyme
Other DBs
CAS: 606-39-3
PubChem: 5166
ChEBI: 16445
3DMET: B00386
NIKKAJI: J838.842C
KCF data

ATOM        15
            1   C2y C    19.2617  -15.6466
            2   C2y C    17.8898  -15.9587
            3   C7x C    19.9834  -16.8560
            4   C2x C    19.8794  -14.3658
            5   C7x C    17.9094  -17.3305
            6   C2y C    16.7911  -15.0810
            7   O7x O    19.1512  -17.8962
            8   O6a O    21.3617  -16.8820
            9   C2y C    19.2617  -13.0980
            10  O6a O    16.7455  -18.1368
            11  C2x C    16.7845  -13.6571
            12  O1a O    15.5167  -15.6987
            13  C5x C    17.8898  -12.7860
            14  O1a O    20.1460  -11.9927
            15  O5x O    17.5777  -11.4075
BOND        16
            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     3   8 2
            8     4   9 2
            9     5  10 2
            10    6  11 2
            11    6  12 1
            12    9  13 1
            13    9  14 1
            14   13  15 2
            15    5   7 1
            16   11  13 1

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