KEGG   COMPOUND: C08731Help
Entry
C08731                      Compound                               

Name
Xenognosin A
Formula
C16H16O3
Exact mass
256.1099
Mol weight
256.2964
Structure
Mol fileKCF fileDB search
Other DBs
CAS: 76907-79-4
PubChem: 10924
ChEBI: 10075
ChEMBL: CHEMBL1087026
KNApSAcK: C00002390
3DMET: B02363
NIKKAJI: J2.766.817H
KCF data Show

ATOM        19
            1   C8y C    26.1882  -20.2573
            2   C8y C    24.9767  -20.9562
            3   C8x C    26.1882  -18.8594
            4   C1b C    27.3995  -20.9562
            5   C8x C    23.7596  -20.2573
            6   O2a O    24.9767  -22.3540
            7   C8x C    24.9767  -18.1548
            8   C2b C    28.6051  -20.2573
            9   C8y C    23.7596  -18.8594
            10  C1a C    23.7653  -23.0586
            11  C2b C    28.6051  -18.8537
            12  O1a O    22.5480  -18.1548
            13  C8y C    29.8166  -18.1489
            14  C8x C    31.0280  -18.8594
            15  C8x C    29.8107  -16.7570
            16  C8x C    32.2393  -18.1548
            17  C8x C    31.0223  -16.0581
            18  C8y C    32.2393  -16.7511
            19  O1a O    33.4509  -16.0581
BOND        20
            1     1   2 2
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     3   7 2
            7     4   8 1
            8     5   9 2
            9     6  10 1
            10    8  11 2
            11    9  12 1
            12   11  13 1
            13   13  14 2
            14   13  15 1
            15   14  16 1
            16   15  17 2
            17   16  18 2
            18   18  19 1
            19    7   9 1
            20   17  18 1

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